Mock Version: 3.0 ENTER ['do_with_status'](['bash', '--login', '-c', '/usr/bin/rpmbuild -bs --target ppc64le --nodeps /builddir/build/SPECS/elk.spec'], chrootPath='/var/lib/mock/fedora-rawhide-ppc64le-1650943175.407257/root'env={'TERM': 'vt100', 'SHELL': '/bin/bash', 'HOME': '/builddir', 'HOSTNAME': 'mock', 'PATH': '/usr/bin:/bin:/usr/sbin:/sbin', 'PROMPT_COMMAND': 'printf "\\033]0;\\007"', 'PS1': ' \\s-\\v\\$ ', 'LANG': 'C.UTF-8'}shell=Falselogger=timeout=0uid=1001gid=135user='mockbuild'nspawn_args=['--capability=cap_ipc_lock', '--rlimit=RLIMIT_NOFILE=10240', '--capability=cap_ipc_lock', '--bind=/tmp/mock-resolv.665w7rlc:/etc/resolv.conf', '--bind=/dev/btrfs-control', '--bind=/dev/loop-control', '--bind=/dev/loop0', '--bind=/dev/loop1', '--bind=/dev/loop2', '--bind=/dev/loop3', '--bind=/dev/loop4', '--bind=/dev/loop5', '--bind=/dev/loop6', '--bind=/dev/loop7', '--bind=/dev/loop8', '--bind=/dev/loop9', '--bind=/dev/loop10', '--bind=/dev/loop11']unshare_net=TrueprintOutput=True) Using nspawn with args ['--capability=cap_ipc_lock', '--rlimit=RLIMIT_NOFILE=10240', '--capability=cap_ipc_lock', '--bind=/tmp/mock-resolv.665w7rlc:/etc/resolv.conf', '--bind=/dev/btrfs-control', '--bind=/dev/loop-control', '--bind=/dev/loop0', '--bind=/dev/loop1', '--bind=/dev/loop2', '--bind=/dev/loop3', '--bind=/dev/loop4', '--bind=/dev/loop5', '--bind=/dev/loop6', '--bind=/dev/loop7', '--bind=/dev/loop8', '--bind=/dev/loop9', '--bind=/dev/loop10', '--bind=/dev/loop11'] Executing command: ['/usr/bin/systemd-nspawn', '-q', '-M', '7dadda4fc74a4d7daacec8c598b62f52', '-D', '/var/lib/mock/fedora-rawhide-ppc64le-1650943175.407257/root', '-a', '-u', 'mockbuild', '--capability=cap_ipc_lock', '--rlimit=RLIMIT_NOFILE=10240', '--capability=cap_ipc_lock', '--bind=/tmp/mock-resolv.665w7rlc:/etc/resolv.conf', '--bind=/dev/btrfs-control', '--bind=/dev/loop-control', '--bind=/dev/loop0', '--bind=/dev/loop1', '--bind=/dev/loop2', '--bind=/dev/loop3', '--bind=/dev/loop4', '--bind=/dev/loop5', '--bind=/dev/loop6', '--bind=/dev/loop7', '--bind=/dev/loop8', '--bind=/dev/loop9', '--bind=/dev/loop10', '--bind=/dev/loop11', '--console=pipe', '--setenv=TERM=vt100', '--setenv=SHELL=/bin/bash', '--setenv=HOME=/builddir', '--setenv=HOSTNAME=mock', '--setenv=PATH=/usr/bin:/bin:/usr/sbin:/sbin', '--setenv=PROMPT_COMMAND=printf "\\033]0;\\007"', '--setenv=PS1= \\s-\\v\\$ ', '--setenv=LANG=C.UTF-8', '--resolv-conf=off', 'bash', '--login', '-c', '/usr/bin/rpmbuild -bs --target ppc64le --nodeps /builddir/build/SPECS/elk.spec'] with env {'TERM': 'vt100', 'SHELL': '/bin/bash', 'HOME': '/builddir', 'HOSTNAME': 'mock', 'PATH': '/usr/bin:/bin:/usr/sbin:/sbin', 'PROMPT_COMMAND': 'printf "\\033]0;\\007"', 'PS1': ' \\s-\\v\\$ ', 'LANG': 'C.UTF-8', 'SYSTEMD_NSPAWN_TMPFS_TMP': '0', 'SYSTEMD_SECCOMP': '0'} and shell False Building target platforms: ppc64le Building for target ppc64le setting SOURCE_DATE_EPOCH=1643500800 Wrote: /builddir/build/SRPMS/elk-8.3.22-1.fc37.src.rpm Child return code was: 0 ENTER ['do_with_status'](['bash', '--login', '-c', '/usr/bin/rpmbuild -bb --target ppc64le --nodeps /builddir/build/SPECS/elk.spec'], chrootPath='/var/lib/mock/fedora-rawhide-ppc64le-1650943175.407257/root'env={'TERM': 'vt100', 'SHELL': '/bin/bash', 'HOME': '/builddir', 'HOSTNAME': 'mock', 'PATH': '/usr/bin:/bin:/usr/sbin:/sbin', 'PROMPT_COMMAND': 'printf "\\033]0;\\007"', 'PS1': ' \\s-\\v\\$ ', 'LANG': 'C.UTF-8'}shell=Falselogger=timeout=0uid=1001gid=135user='mockbuild'nspawn_args=['--capability=cap_ipc_lock', '--rlimit=RLIMIT_NOFILE=10240', '--capability=cap_ipc_lock', '--bind=/tmp/mock-resolv.665w7rlc:/etc/resolv.conf', '--bind=/dev/btrfs-control', '--bind=/dev/loop-control', '--bind=/dev/loop0', '--bind=/dev/loop1', '--bind=/dev/loop2', '--bind=/dev/loop3', '--bind=/dev/loop4', '--bind=/dev/loop5', '--bind=/dev/loop6', '--bind=/dev/loop7', '--bind=/dev/loop8', '--bind=/dev/loop9', '--bind=/dev/loop10', '--bind=/dev/loop11']unshare_net=TrueprintOutput=True) Using nspawn with args ['--capability=cap_ipc_lock', '--rlimit=RLIMIT_NOFILE=10240', '--capability=cap_ipc_lock', '--bind=/tmp/mock-resolv.665w7rlc:/etc/resolv.conf', '--bind=/dev/btrfs-control', '--bind=/dev/loop-control', '--bind=/dev/loop0', '--bind=/dev/loop1', '--bind=/dev/loop2', '--bind=/dev/loop3', '--bind=/dev/loop4', '--bind=/dev/loop5', '--bind=/dev/loop6', '--bind=/dev/loop7', '--bind=/dev/loop8', '--bind=/dev/loop9', '--bind=/dev/loop10', '--bind=/dev/loop11'] Executing command: ['/usr/bin/systemd-nspawn', '-q', '-M', '503be6fbb3a6438f8870cb1882270f83', '-D', '/var/lib/mock/fedora-rawhide-ppc64le-1650943175.407257/root', '-a', '-u', 'mockbuild', '--capability=cap_ipc_lock', '--rlimit=RLIMIT_NOFILE=10240', '--capability=cap_ipc_lock', '--bind=/tmp/mock-resolv.665w7rlc:/etc/resolv.conf', '--bind=/dev/btrfs-control', '--bind=/dev/loop-control', '--bind=/dev/loop0', '--bind=/dev/loop1', '--bind=/dev/loop2', '--bind=/dev/loop3', '--bind=/dev/loop4', '--bind=/dev/loop5', '--bind=/dev/loop6', '--bind=/dev/loop7', '--bind=/dev/loop8', '--bind=/dev/loop9', '--bind=/dev/loop10', '--bind=/dev/loop11', '--console=pipe', '--setenv=TERM=vt100', '--setenv=SHELL=/bin/bash', '--setenv=HOME=/builddir', '--setenv=HOSTNAME=mock', '--setenv=PATH=/usr/bin:/bin:/usr/sbin:/sbin', '--setenv=PROMPT_COMMAND=printf "\\033]0;\\007"', '--setenv=PS1= \\s-\\v\\$ ', '--setenv=LANG=C.UTF-8', '--resolv-conf=off', 'bash', '--login', '-c', '/usr/bin/rpmbuild -bb --target ppc64le --nodeps /builddir/build/SPECS/elk.spec'] with env {'TERM': 'vt100', 'SHELL': '/bin/bash', 'HOME': '/builddir', 'HOSTNAME': 'mock', 'PATH': '/usr/bin:/bin:/usr/sbin:/sbin', 'PROMPT_COMMAND': 'printf "\\033]0;\\007"', 'PS1': ' \\s-\\v\\$ ', 'LANG': 'C.UTF-8', 'SYSTEMD_NSPAWN_TMPFS_TMP': '0', 'SYSTEMD_SECCOMP': '0'} and shell False Building target platforms: ppc64le Building for target ppc64le setting SOURCE_DATE_EPOCH=1643500800 Executing(%prep): /bin/sh -e /var/tmp/rpm-tmp.PQH0NJ + umask 022 + cd /builddir/build/BUILD + cd /builddir/build/BUILD + rm -rf elk-8.3.22 + /usr/bin/gzip -dc /builddir/build/SOURCES/elk-8.3.22.tgz + /usr/bin/tar -xof - + STATUS=0 + '[' 0 -ne 0 ']' + cd elk-8.3.22 + /usr/bin/chmod -Rf a+rX,u+w,g-w,o-w . + echo 'SRC_MPI = mpi_stub.f90' + echo 'F90 = gfortran -fopenmp -fallow-argument-mismatch' + echo 'F77 = gfortran -fopenmp -fallow-argument-mismatch' + echo 'F90_OPTS = -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + echo 'F77_OPTS = $(F90_OPTS)' + echo 'AR = ar' + echo 'SRC_MKL = mkl_stub.f90' + echo 'SRC_BLIS = blis_stub.f90' + echo 'SRC_W90S = w90_stub.f90' + echo 'LIB_LPK = -L/usr/lib64 -lflexiblas' + echo 'LIB_FFT = -L/usr/lib64 -lfftw3' + echo 'SRC_FFT = zfftifc_fftw.f90' + echo 'LIB_libxc = -L/usr/lib64 -lxc -lxcf90' + echo 'SRC_libxc = libxcf90.f90 libxcifc.f90' + sed -i 's/blas lapack fft elk/elk/' src/Makefile + sed -i s/erf.f90// src/Makefile + sed -i s/,erf// src/stheta_mp.f90 + rm -rf src/LAPACK src/BLAS src/fftlib + rm -f src/libxc_funcs.f90 src/libxc.f90 + rm -f src/erf.f90 + RPM_EC=0 ++ jobs -p + exit 0 Executing(%build): /bin/sh -e /var/tmp/rpm-tmp.UVwVoG + umask 022 + cd /builddir/build/BUILD + CFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + export CFLAGS + CXXFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + export CXXFLAGS + FFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -I/usr/lib64/gfortran/modules' + export FFLAGS + FCFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -I/usr/lib64/gfortran/modules' + export FCFLAGS + LDFLAGS='-Wl,-z,relro -Wl,--as-needed -Wl,-z,now -specs=/usr/lib/rpm/redhat/redhat-hardened-ld -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -Wl,--build-id=sha1 -Wl,-dT,/builddir/build/BUILD/elk-8.3.22/.package_note-elk-8.3.22-1.fc37.ppc64le.ld' + export LDFLAGS + LT_SYS_LIBRARY_PATH=/usr/lib64: + export LT_SYS_LIBRARY_PATH + CC=gcc + export CC + CXX=g++ + export CXX + '[' -f /usr/lib/rpm/generate-rpm-note.sh ']' + /usr/lib/rpm/generate-rpm-note.sh elk 8.3.22-1.fc37 ppc64le + cd elk-8.3.22 + mv src src.orig + export MPI_SUFFIX=_openmp + MPI_SUFFIX=_openmp + cp -rp src.orig src + cp -p make.inc.common make.inc + cat make.inc SRC_MPI = mpi_stub.f90 F90 = gfortran -fopenmp -fallow-argument-mismatch F77 = gfortran -fopenmp -fallow-argument-mismatch F90_OPTS = -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection F77_OPTS = $(F90_OPTS) AR = ar SRC_MKL = mkl_stub.f90 SRC_BLIS = blis_stub.f90 SRC_W90S = w90_stub.f90 LIB_LPK = -L/usr/lib64 -lflexiblas LIB_FFT = -L/usr/lib64 -lfftw3 SRC_FFT = zfftifc_fftw.f90 LIB_libxc = -L/usr/lib64 -lxc -lxcf90 SRC_libxc = libxcf90.f90 libxcifc.f90 + cp -p make.inc make.inc_openmp + /usr/bin/make cd src; make all make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modmain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modmain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mpi_stub.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mpi_stub.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpi_stub.f90:41:29: 41 | subroutine mpi_comm_size(comm,size,ierror) | 1 Warning: Unused dummy argument 'comm' at (1) [-Wunused-dummy-argument] mpi_stub.f90:50:29: 50 | subroutine mpi_comm_rank(comm,rank,ierror) | 1 Warning: Unused dummy argument 'comm' at (1) [-Wunused-dummy-argument] mpi_stub.f90:59:27: 59 | subroutine mpi_barrier(comm,ierror) | 1 Warning: Unused dummy argument 'comm' at (1) [-Wunused-dummy-argument] mpi_stub.f90:66:27: 66 | subroutine mpi_bcast(buffer,count,datatype,root,comm,ierror) | 1 Warning: Unused dummy argument 'buffer' at (1) [-Wunused-dummy-argument] mpi_stub.f90:66:52: 66 | subroutine mpi_bcast(buffer,count,datatype,root,comm,ierror) | 1 Warning: Unused dummy argument 'comm' at (1) [-Wunused-dummy-argument] mpi_stub.f90:66:33: 66 | subroutine mpi_bcast(buffer,count,datatype,root,comm,ierror) | 1 Warning: Unused dummy argument 'count' at (1) [-Wunused-dummy-argument] mpi_stub.f90:66:42: 66 | subroutine mpi_bcast(buffer,count,datatype,root,comm,ierror) | 1 Warning: Unused dummy argument 'datatype' at (1) [-Wunused-dummy-argument] mpi_stub.f90:66:47: 66 | subroutine mpi_bcast(buffer,count,datatype,root,comm,ierror) | 1 Warning: Unused dummy argument 'root' at (1) [-Wunused-dummy-argument] mpi_stub.f90:77:63: 77 | subroutine mpi_allreduce(sendbuf,recvbuf,count,datatype,op,comm,ierror) | 1 Warning: Unused dummy argument 'comm' at (1) [-Wunused-dummy-argument] mpi_stub.f90:77:46: 77 | subroutine mpi_allreduce(sendbuf,recvbuf,count,datatype,op,comm,ierror) | 1 Warning: Unused dummy argument 'count' at (1) [-Wunused-dummy-argument] mpi_stub.f90:77:55: 77 | subroutine mpi_allreduce(sendbuf,recvbuf,count,datatype,op,comm,ierror) | 1 Warning: Unused dummy argument 'datatype' at (1) [-Wunused-dummy-argument] mpi_stub.f90:77:58: 77 | subroutine mpi_allreduce(sendbuf,recvbuf,count,datatype,op,comm,ierror) | 1 Warning: Unused dummy argument 'op' at (1) [-Wunused-dummy-argument] mpi_stub.f90:77:40: 77 | subroutine mpi_allreduce(sendbuf,recvbuf,count,datatype,op,comm,ierror) | 1 Warning: Unused dummy argument 'recvbuf' at (1) [-Wunused-dummy-argument] mpi_stub.f90:77:32: 77 | subroutine mpi_allreduce(sendbuf,recvbuf,count,datatype,op,comm,ierror) | 1 Warning: Unused dummy argument 'sendbuf' at (1) [-Wunused-dummy-argument] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modmpi.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modmpi.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modramdisk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modramdisk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined modramdisk.f90:282:48: 264 | call rvcopy(3,file(fnum)%rec(irec)%dat(i),v1) | 2 ...... 282 | call rvcopy(2*nzv,file(fnum)%rec(irec)%dat(i),zva) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/REAL(8)). modramdisk.f90:189:16: 189 | call rvcopy(3,v1,file(fnum)%rec(irec)%dat(i)) | 1 ...... 264 | call rvcopy(3,file(fnum)%rec(irec)%dat(i),v1) | 2 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/INTEGER(4)). gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c libxcf90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: libxcf90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined libxcf90.f90:2212:26: 2212 | subroutine c_to_f_string(c_string, f_string) | ^ Warning: 'c_to_f_string' defined but not used [-Wunused-function] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c libxcifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: libxcifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modxcifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modxcifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modfxcifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modfxcifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c moddftu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: moddftu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modrdm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modrdm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modphonon.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modphonon.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modtest.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modtest.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modrandom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modrandom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modstore.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modstore.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modpw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modpw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modvars.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modvars.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modtddft.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modtddft.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modgw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modgw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modbog.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modbog.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c moddelf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: moddelf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modomp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modomp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mkl_stub.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mkl_stub.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mkl_stub.f90:8:42: 8 | subroutine mkl_set_num_threads(num_threads) | 1 Warning: Unused dummy argument 'num_threads' at (1) [-Wunused-dummy-argument] mkl_stub.f90:13:54: 13 | integer function mkl_set_num_threads_local(num_threads) | 1 Warning: Unused dummy argument 'num_threads' at (1) [-Wunused-dummy-argument] mkl_stub.f90:19:34: 19 | subroutine mkl_set_dynamic(dynamic) | 1 Warning: Unused dummy argument 'dynamic' at (1) [-Wunused-dummy-argument] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mkl_init.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mkl_init.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oblas_init.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oblas_init.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c blis_stub.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: blis_stub.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined blis_stub.f90:8:49: 8 | subroutine bli_thread_set_num_threads(num_threads) | 1 Warning: Unused dummy argument 'num_threads' at (1) [-Wunused-dummy-argument] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c blis_init.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: blis_init.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c w90_stub.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: w90_stub.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined w90_stub.f90:10:31: 10 | num_atoms_loc,atom_symbols_loc,atoms_cart_loc, gamma_only_loc,spinors_loc, & | 1 Warning: Unused dummy argument 'atom_symbols_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:10:46: 10 | num_atoms_loc,atom_symbols_loc,atoms_cart_loc, gamma_only_loc,spinors_loc, & | 1 Warning: Unused dummy argument 'atoms_cart_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:43: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'exclude_bands_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:10:62: 10 | num_atoms_loc,atom_symbols_loc,atoms_cart_loc, gamma_only_loc,spinors_loc, & | 1 Warning: Unused dummy argument 'gamma_only_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:9:48: 9 | real_lattice_loc,recip_lattice_loc,kpt_latt_loc,num_bands_tot, & | 1 Warning: Unused dummy argument 'kpt_latt_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:8:47: 8 | subroutine wannier_setup(seed__name,mp_grid_loc,num_kpts_loc, & | 1 Warning: Unused dummy argument 'mp_grid_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:32: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'nncell_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:21: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'nnlist_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:10: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'nntot_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:46: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'num_bands_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:59: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'num_wann_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:25: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_l_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:36: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_m_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:52: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_radial_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:54: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'proj_s_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:71: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'proj_s_qaxis_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:14: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_site_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:11: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'proj_x_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:63: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_z_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:25: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'proj_zona_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:9:17: 9 | real_lattice_loc,recip_lattice_loc,kpt_latt_loc,num_bands_tot, & | 1 Warning: Unused dummy argument 'real_lattice_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:9:35: 9 | real_lattice_loc,recip_lattice_loc,kpt_latt_loc,num_bands_tot, & | 1 Warning: Unused dummy argument 'recip_lattice_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:8:35: 8 | subroutine wannier_setup(seed__name,mp_grid_loc,num_kpts_loc, & | 1 Warning: Unused dummy argument 'seed__name' at (1) [-Wunused-dummy-argument] w90_stub.f90:10:74: 10 | num_atoms_loc,atom_symbols_loc,atoms_cart_loc, gamma_only_loc,spinors_loc, & | 1 Warning: Unused dummy argument 'spinors_loc' at (1) [-Wunused-dummy-argument] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modw90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modw90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfftifc_fftw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfftifc_fftw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c elk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: elk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mtm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mtm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3vo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3vo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wigner3j.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wigner3j.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengvc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengvc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potnucl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potnucl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvsig.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvsig.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findngkmax.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findngkmax.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potks.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potks.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mtdmin.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mtdmin.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mtdmin.f90: In function 'mtdmin_': mtdmin.f90:67:17: warning: 'rm' may be used uninitialized [-Wmaybe-uninitialized] 67 | dmin=sqrt(d2m)-rm | ^ mtdmin.f90:30:22: note: 'rm' was declared here 30 | real(8) d2,d2m,r,r2,rm,dr,drm | ^ mtdmin.f90:67:17: warning: 'd2m' may be used uninitialized [-Wmaybe-uninitialized] 67 | dmin=sqrt(d2m)-rm | ^ mtdmin.f90:30:14: note: 'd2m' was declared here 30 | real(8) d2,d2m,r,r2,rm,dr,drm | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfcopy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfcopy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomagv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomagv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genffacgp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genffacgp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c unitary.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: unitary.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zmdet.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zmdet.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtftoc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtftoc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zminv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zminv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeeval.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeeval.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mixerifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mixerifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c splinew.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: splinew.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c nfftifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: nfftifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symdmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symdmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c z2mm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: z2mm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c z2mctm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: z2mctm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c z2mmct.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: z2mmct.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c axangsu2.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: axangsu2.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradzvcln.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradzvcln.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentpmae.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentpmae.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfcmtwr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfcmtwr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c projsbf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: projsbf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradzf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradzf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c timesec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: timesec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtftoc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtftoc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ztorfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ztorfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtctof.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtctof.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnfvz.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnfvz.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c energynn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: energynn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gaunt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gaunt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potxcmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potxcmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined potxcmt.f90: In function 'potxcmt_': potxcmt.f90:33:41: warning: 'bxc.offset' may be used uninitialized [-Wmaybe-uninitialized] 33 | real(8), allocatable :: mag(:,:),bxc(:,:),tau(:,:) | ^ potxcmt.f90:33:41: warning: 'bxc.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] potxcmt.f90:41:45: warning: 'wcdn.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 41 | real(8), allocatable :: wc(:),wcup(:),wcdn(:) | ^ potxcmt.f90:41:29: warning: 'wc.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 41 | real(8), allocatable :: wc(:),wcup(:),wcdn(:) | ^ potxcmt.f90:31:45: warning: 'vxdn.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 31 | real(8), allocatable :: vx(:),vxup(:),vxdn(:) | ^ potxcmt.f90:293:22: warning: 'vc.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 293 | vxc(:)=vx(:)+vc(:) | ^ potxcmt.f90:32:29: note: 'vc.dim[0].ubound' was declared here 32 | real(8), allocatable :: vc(:),vcup(:),vcdn(:) | ^ potxcmt.f90:33:50: warning: 'tau.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 33 | real(8), allocatable :: mag(:,:),bxc(:,:),tau(:,:) | ^ potxcmt.f90:33:50: warning: 'tau.offset' may be used uninitialized [-Wmaybe-uninitialized] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta_mp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta_mp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta_mp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta_mp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta_fd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta_fd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta_fd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta_fd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writelsj.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writelsj.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnzh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnzh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gensmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gensmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gensfacgp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gensfacgp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomag.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomag.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wsplintp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wsplintp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c checkmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: checkmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c reciplat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: reciplat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradrf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradrf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzfrm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzfrm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mixadapt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mixadapt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zftrf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zftrf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sbessel.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sbessel.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengclgq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengclgq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gencfun.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gencfun.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c factr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: factr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genstress.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genstress.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c force.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: force.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined force.f90: In function 'force_': force.f90:84:16: warning: 't2' may be used uninitialized [-Wmaybe-uninitialized] 84 | real(8) ca,t1,t2 | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvbmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvbmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genvbmatk.f90:50:17: 50 | wfmt1(1:npc,:)=wfmt(1:npc,ias,1,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genvbmatk.f90:51:22: 51 | wfmt1(npc+1:npc2,:)=wfmt(1:npc,ias,2,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genvbmatk.f90:95:18: 95 | wfmt4(1:npc2)=wfmt2(1:npc2) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c forcek.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: forcek.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined forcek.f90: In function 'forcek_': forcek.f90:42:52: warning: 'evecsv.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 42 | complex(8), allocatable :: evecfv(:,:,:),evecsv(:,:) | ^ forcek.f90:42:52: warning: 'evecsv.offset' may be used uninitialized [-Wmaybe-uninitialized] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeepsinv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeepsinv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olprad.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olprad.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c polark.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: polark.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hflocal.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hflocal.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mixbroyden.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mixbroyden.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c grad2rfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: grad2rfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c clebgor.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: clebgor.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfirctof.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfirctof.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c effmass.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: effmass.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zpotcoul.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zpotcoul.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sfacmag.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sfacmag.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c polynm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: polynm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c epsinv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: epsinv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfinpc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfinpc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zmctmu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zmctmu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zmctm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zmctm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeiad.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeiad.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genapwfr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genapwfr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengclq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengclq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c addbfsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: addbfsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genylmv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genylmv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genexpmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genexpmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c factnm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: factnm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sphcover.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sphcover.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sctovec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sctovec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genppts.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genppts.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnzg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnzg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fderiv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fderiv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genexpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genexpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genexpmat.f90: In function 'genexpmat_': genexpmat.f90:26:39: warning: 'evecsv1.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 26 | complex(8), allocatable :: evecsv1(:,:),evecsv2(:,:) | ^ genexpmat.f90:26:39: warning: 'evecsv1.offset' may be used uninitialized [-Wmaybe-uninitialized] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeforces.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeforces.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3cross.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3cross.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c match.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: match.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genspchi0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genspchi0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzrho.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzrho.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potefield.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potefield.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhoinit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhoinit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined eveqnsv.f90:100:21: 100 | wfmt6(1:npc,ist)=wfmt1(1:npc,ist) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] eveqnsv.f90: In function 'eveqnsv_': eveqnsv.f90:26:10: warning: 'a1' may be used uninitialized [-Wmaybe-uninitialized] 26 | real(8) a1,a2,a3,t1 | ^ eveqnsv.f90:26:13: warning: 'a2' may be used uninitialized [-Wmaybe-uninitialized] 26 | real(8) a1,a2,a3,t1 | ^ eveqnsv.f90:303:25: warning: 'a3' may be used uninitialized [-Wmaybe-uninitialized] 303 | deallocate(wfir1,wfir2) | ^ eveqnsv.f90:26:16: note: 'a3' was declared here 26 | real(8) a1,a2,a3,t1 | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c roteuler.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: roteuler.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genrmesh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genrmesh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c splint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: splint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wavefcr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wavefcr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined wavefcr.f90: In function 'wavefcr_': wavefcr.f90:123:16: warning: 'i2' may be used uninitialized [-Wmaybe-uninitialized] 123 | i2=i2+lmmaxo | ^ wavefcr.f90:19:15: note: 'i2' was declared here 19 | integer i,i1,i2 | ^ wavefcr.f90:122:16: warning: 'i1' may be used uninitialized [-Wmaybe-uninitialized] 122 | i1=i1+lmmaxo | ^ wavefcr.f90:19:12: note: 'i1' was declared here 19 | integer i,i1,i2 | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c lopzflm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: lopzflm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c brzint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: brzint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rotdmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rotdmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genylmg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genylmg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentaucr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentaucr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readinput.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readinput.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c numlist.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: numlist.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hermite.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hermite.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genfspecies.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genfspecies.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c atpstep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: atpstep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmatls.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmatls.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeengy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeengy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writechg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writechg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rbsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rbsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genlofr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genlofr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rotrfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rotrfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zftzf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zftzf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genpmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genpmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rvfcross.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rvfcross.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeinfo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeinfo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mossbauer.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mossbauer.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c initoep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: initoep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c i3minv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: i3minv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genidxlo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genidxlo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c nuclei.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: nuclei.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeefg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeefg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevsp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevsp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gencore.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gencore.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mtv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mtv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3minv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3minv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3frac.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3frac.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genapwlofr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genapwlofr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gridsize.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gridsize.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrfir.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrfir.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c geomplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: geomplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ylmroty.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ylmroty.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengvclns.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengvclns.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ssfext.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ssfext.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writestate.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writestate.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta_sq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta_sq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potxcir.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potxcir.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined potxcir.f90: In function 'potxcir_': potxcir.f90:26:45: warning: 'vxdn.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 26 | real(8), allocatable :: vx(:),vxup(:),vxdn(:) | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potxc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potxc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rzfmtinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rzfmtinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhoplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhoplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c occupy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: occupy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symveca.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symveca.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c jprplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: jprplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genvmatk.f90:49:19: 49 | wfmt1(1:npc,:)=wfmt(1:npc,ias,ispn,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genvmatk.f90:54:19: 54 | wfmt2(1:npc)=vmt(1:npc,ias)*wfmt(1:npc,ias,ispn,jst) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genvmatk.f90:63:23: 63 | wfmt2(1:npc)=wfmt2(1:npc)+wfmt3(1:npc) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c geomopt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: geomopt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnss.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnss.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined eveqnss.f90: In function 'eveqnss_._omp_fn.0': eveqnss.f90:66:43: warning: 'IMAGPART_EXPR ' may be used uninitialized [-Wmaybe-uninitialized] 66 | if (ssdph.and.(ispn.eq.2)) zq=conjg(zq) | ^ eveqnss.f90:25:13: note: 'IMAGPART_EXPR ' was declared here 25 | complex(8) zq | ^ eveqnss.f90:72:63: warning: 'REALPART_EXPR ' may be used uninitialized [-Wmaybe-uninitialized] 72 | if (ssdph) wfmt1(1:npc,ist,ispn)=zq*wfmt1(1:npc,ist,ispn) | ^ eveqnss.f90:25:13: note: 'REALPART_EXPR ' was declared here 25 | complex(8) zq | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hartfock.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hartfock.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined hartfock.f90:200:17: 124 | call mpi_bcast(evalsv(:,ik),nstsv,mpi_double_precision,lp,mpicom,ierror) | 2 ...... 200 | call mpi_bcast(tlast,1,mpi_logical,0,mpicom,ierror) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (LOGICAL(4)/REAL(8)). gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfpw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfpw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlxbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlxbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlxbsek.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlxbsek.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmldbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmldbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmldbsek.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmldbsek.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradwfcr2.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradwfcr2.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oepresk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oepresk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined oepresk.f90:172:50: 172 | call rzadd(npcmt(is),za,zfmt(:,ias),rfmt(:,ias)) | 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) oepresk.f90:174:30: 174 | call rzadd(ngtot,za,zfir,rfir) | 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) oepresk.f90:81:51: 81 | call rzadd(npc,z1,zfmt1,dvxmt(:,ias)) | 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) oepresk.f90:83:65: 83 | call rzadd(npc,z1,zvfmt1(:,idm),dbxmt(:,ias,idm)) | 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) oepresk.f90: In function 'oepresk_': oepresk.f90:26:40: warning: 'zvfmt2.dim[2].stride' may be used uninitialized [-Wmaybe-uninitialized] 26 | complex(8), allocatable :: zvfmt2(:,:,:),zvfir2(:,:) | ^ oepresk.f90:26:52: warning: 'zvfir2.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 26 | complex(8), allocatable :: zvfmt2(:,:,:),zvfir2(:,:) | ^ oepresk.f90:24:47: warning: 'zvfmt1.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 24 | complex(8), allocatable :: zfmt1(:),zvfmt1(:,:) | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c addlorbcnd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: addlorbcnd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c energy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: energy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oepvcl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oepvcl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oepvclk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oepvclk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined oepvclk.f90:98:35: 55 | call genwfsv(.false.,.false.,nstsv,0,ngdgc,igfc,ngk(1,ikp),igkig(:,1,ikp), & | 2 ...... 98 | call genwfsv(.false.,.false.,nst,idx,ngdgc,igfc,ngk(1,ik),igkig(:,1,ik), & | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c polar.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: polar.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dbxcplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dbxcplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sbesseldm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sbesseldm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writehmlbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writehmlbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dielectric_bse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dielectric_bse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vecplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vecplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c nesting.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: nesting.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c emdplot3d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: emdplot3d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c emdplot2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: emdplot2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c emdplot1d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: emdplot1d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfhkintp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfhkintp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rfhkintp.f90: In function 'rfhkintp_': rfhkintp.f90:65:34: warning: 'v0[0]' may be used uninitialized [-Wmaybe-uninitialized] 65 | t2=(vhpl(1)-v0(1))*dble(ngridk(1)) | ^ rfhkintp.f90:20:13: note: 'v0[0]' was declared here 20 | real(8) v0(3),v1(3),v2(3),t1,t2 | ^ rfhkintp.f90:71:34: warning: 'v0[1]' may be used uninitialized [-Wmaybe-uninitialized] 71 | t2=(vhpl(2)-v0(2))*dble(ngridk(2)) | ^ rfhkintp.f90:20:13: note: 'v0[1]' was declared here 20 | real(8) v0(3),v1(3),v2(3),t1,t2 | ^ rfhkintp.f90:75:34: warning: 'v0[2]' may be used uninitialized [-Wmaybe-uninitialized] 75 | t2=(vhpl(3)-v0(3))*dble(ngridk(3)) | ^ rfhkintp.f90:20:13: note: 'v0[2]' was declared here 20 | real(8) v0(3),v1(3),v2(3),t1,t2 | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writewfpw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writewfpw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vblocal.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vblocal.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writefsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writefsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getwfpw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getwfpw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotpt1d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotpt1d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init2.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init2.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findsymcrys.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findsymcrys.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined findsymcrys.f90: In function 'findsymcrys_': findsymcrys.f90:39:13: warning: 'v0[0]' may be used uninitialized [-Wmaybe-uninitialized] 39 | real(8) v0(3),v1(3),v2(3),t1 | ^ findsymcrys.f90:39:13: warning: 'v0[1]' may be used uninitialized [-Wmaybe-uninitialized] findsymcrys.f90:195:27: warning: 'v0[2]' may be used uninitialized [-Wmaybe-uninitialized] 195 | v1(:)=atposl(:,1,1)-v0(:) | ^ findsymcrys.f90:39:13: note: 'v0[2]' was declared here 39 | real(8) v0(3),v1(3),v2(3),t1 | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotpt3d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotpt3d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c elnes.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: elnes.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fermisurfbxsf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fermisurfbxsf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genspecies.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genspecies.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeexpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeexpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writekpts.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writekpts.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfcrplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfcrplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writedos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writedos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c energykncr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: energykncr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_sp_1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_sp_1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_sp_1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_sp_1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_2a.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_2a.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_2a.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_2a.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_2b.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_2b.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_2b.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_2b.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_sp_2a.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_sp_2a.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_sp_2a.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_sp_2a.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_sp_2b.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_sp_2b.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_sp_2b.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_sp_2b.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeemd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeemd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c reademd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: reademd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c emdplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: emdplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init3.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init3.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init4.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init4.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bfieldfsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bfieldfsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c testcheck.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: testcheck.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c pade.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: pade.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wsplint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wsplint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gensocfr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gensocfr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c pades.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: pades.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genscss.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genscss.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfcmtwr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfcmtwr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c nonlinopt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: nonlinopt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writelat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writelat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhocore.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhocore.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rzfinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rzfinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readspecies.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readspecies.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findband.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findband.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c exxengy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: exxengy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentauk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentauk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradrfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradrfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c checkfsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: checkfsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genrlmv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genrlmv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mae.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mae.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegvecrf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegvecrf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zcfmtwr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zcfmtwr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfmtsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfmtsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpistl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpistl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlistl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlistl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpalo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpalo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlalo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlalo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olplolo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olplolo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmllolo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmllolo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpaa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpaa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlaa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlaa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengclg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengclg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomagsh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomagsh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c charge.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: charge.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c moment.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: moment.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfint0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfint0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mdet.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mdet.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gencfrc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gencfrc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c checkstop.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: checkstop.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genbs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genbs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfirsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfirsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradwf2.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradwf2.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c closefiles.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: closefiles.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writelinen.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writelinen.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtlm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtlm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtpack.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtpack.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtpack.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtpack.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevalfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevalfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevalfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevalfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfmtfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfmtfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putkmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putkmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getkmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getkmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putepsinv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putepsinv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getcfgq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getcfgq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevalsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevalsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevalsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevalsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevecsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevecsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevecsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevecsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genshtmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genshtmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genshtmat.f90:77:12: 77 | cbshti(:,:)=zbshti(:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genshtmat.f90:78:12: 78 | cfshti(:,:)=zfshti(:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genshtmat.f90:125:12: 125 | cbshto(:,:)=zbshto(:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genshtmat.f90:126:12: 126 | cfshto(:,:)=zfshto(:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c allatoms.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: allatoms.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevecfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevecfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevecfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevecfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writesym.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writesym.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putoccsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putoccsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getoccsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getoccsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c torque.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: torque.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findqpt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findqpt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findkpt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findkpt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genevfsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genevfsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sortidx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sortidx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c radnucl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: radnucl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrvf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrvf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeqpts.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeqpts.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rndevsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rndevsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengkvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengkvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mixlinear.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mixlinear.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writesf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writesf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengqf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengqf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genkmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genkmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genolpq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genolpq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjlgprmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjlgprmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfinterp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfinterp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fsmooth.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fsmooth.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c axangrot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: axangrot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rotaxang.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rotaxang.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wspline.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wspline.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c splined.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: splined.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findswidth.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findswidth.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findsymlat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findsymlat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writepmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writepmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genstrain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genstrain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symmetry.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symmetry.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c linengy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: linengy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writestress.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writestress.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eulerrot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eulerrot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zftwfir.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zftwfir.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rschrodint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rschrodint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegclq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegclq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegeom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegeom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writemom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writemom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c curlrvf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: curlrvf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzvclmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzvclmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjtot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjtot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c checkwrite.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: checkwrite.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjprk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjprk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c proj2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: proj2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genidxbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genidxbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrvfir.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrvfir.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjpr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjpr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnfvr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnfvr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentau.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentau.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjlgpr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjlgpr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writestrain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writestrain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writefermi.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writefermi.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtctof.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtctof.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findsym.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findsym.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhonorm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhonorm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvchi0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvchi0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtconj.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtconj.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta_sq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta_sq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta_lr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta_lr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta_lr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta_lr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findsymsite.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findsymsite.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genlmirep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genlmirep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writespecies.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writespecies.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomagk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomagk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrvfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrvfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wigner3jf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wigner3jf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genhvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genhvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ylmrot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ylmrot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wxcplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wxcplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c massnucl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: massnucl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c straingkq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: straingkq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oepmain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oepmain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdirac.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdirac.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bandstr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bandstr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sfacinit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sfacinit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findscq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findscq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plot1d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plot1d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plot2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plot2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plot3d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plot3d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readstate.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readstate.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnhf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnhf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined eveqnhf.f90:119:35: 52 | call genwfsv(.false.,.true.,nstsv,0,ngdgc,igfc,ngk(1,ikp),igkig(:,1,ikp), & | 2 ...... 119 | call genwfsv(.false.,.false.,nst,idx,ngdgc,igfc,ngk(1,ik),igkig(:,1,ik), & | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zbsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zbsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c i3mtv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: i3mtv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c spline.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: spline.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gauntyry.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gauntyry.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findnjcmax.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findnjcmax.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gndstate.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gndstate.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sstask.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sstask.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fermisurf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fermisurf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c spiralsc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: spiralsc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c atom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: atom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c maginit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: maginit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c exxengyk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: exxengyk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_c_tb09.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_c_tb09.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c moke.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: moke.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlrad.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlrad.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dos.f90: In function 'dos_': dos.f90:343:25: warning: 'elm.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 343 | lm,elm(lm,ias) | ^ dos.f90:60:50: note: 'elm.dim[1].stride' was declared here 60 | real(8), allocatable :: dt(:,:),dp(:,:,:),elm(:,:) | ^ dos.f90:343:25: warning: 'elm.offset' may be used uninitialized [-Wmaybe-uninitialized] 343 | lm,elm(lm,ias) | ^ dos.f90:60:50: note: 'elm.offset' was declared here 60 | real(8), allocatable :: dt(:,:),dp(:,:,:),elm(:,:) | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findprimcell.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findprimcell.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotpt2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotpt2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sfacrho.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sfacrho.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bdipole.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bdipole.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dielectric.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dielectric.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c elfplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: elfplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vclcore.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vclcore.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtwr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtwr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zvcldisp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zvcldisp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vecfbz.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vecfbz.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gcd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gcd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c lopzflmn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: lopzflmn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zpotclmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zpotclmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readfermi.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readfermi.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gensdmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gensdmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sphcrd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sphcrd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potcoul.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potcoul.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzrm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzrm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rminv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rminv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rtozfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rtozfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfsvp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfsvp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdiracint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdiracint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rotzflm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rotzflm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c latvstep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: latvstep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradzfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradzfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c cbsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: cbsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c cfsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: cfsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfmtsv_sp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfmtsv_sp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined wfmtsv_sp.f90:196:8: 196 | cf(1,:)=cf(1,:)+z*rf(1,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfirsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfirsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfsv_sp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfsv_sp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_4.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_4.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_4.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_4.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c trzhmm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: trzhmm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rvcopy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rvcopy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dolpistl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dolpistl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmlistl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmlistl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpaloq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpaloq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlaloq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlaloq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dolpalo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dolpalo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmlalo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmlalo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmllolo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmllolo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpaaq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpaaq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dolpaa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dolpaa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmlaa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmlaa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlaaq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlaaq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c initeph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: initeph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined initeph.f90:105:26: 105 | ephmkq(:,:,:,ik,iq)=ephmat(:,:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dengyeph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dengyeph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gndsteph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gndsteph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gndsteph.f90:46:42: 42 | call mixerifc(mixtype,nmix,duvwx,dv,nwork,duvwx) | 2 ...... 46 | call mixerifc(mixtype,nmix,duvwx,dv,nwork,work) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/COMPLEX(8)). gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqneph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqneph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined eveqneph.f90:62:19: 60 | call mpi_bcast(evalwx(:,iq),nbph,mpi_double_precision,lp,mpicom,ierror) | 2 61 | call mpi_bcast(xnorm(:,iq),nbph,mpi_double_precision,lp,mpicom,ierror) 62 | call mpi_bcast(dxx(:,:,iq),n,mpi_double_complex,lp,mpicom,ierror) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/REAL(8)). gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlepha.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlepha.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlephb.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlephb.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlephde.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlephde.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getephmkq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getephmkq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ephdos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ephdos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradrhomt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradrhomt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendcfun.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendcfun.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendvsig.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendvsig.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c drhomagsh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: drhomagsh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c doccupy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: doccupy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmlrad.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmlrad.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendwfsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendwfsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gendwfsv.f90: In function 'gendwfsv_': gendwfsv.f90:32:58: warning: 'dwfmt1.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 32 | complex(8), allocatable :: wfmt1(:,:),wfmt2(:),dwfmt1(:,:) | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dwfmtfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dwfmtfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengqvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengqvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmatch.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmatch.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writedvs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writedvs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readdyn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readdyn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dyntask.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dyntask.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dpotks.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dpotks.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dpotxc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dpotxc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dpotxc.f90: In function 'dpotxc_': dpotxc.f90:16:44: warning: 'dbmt.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 16 | complex(8), allocatable :: dvmt(:),dbmt(:,:),zfmt(:) | ^ dpotxc.f90:16:44: warning: 'dbmt.offset' may be used uninitialized [-Wmaybe-uninitialized] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c deveqnfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: deveqnfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dpotcoul.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dpotcoul.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c drhomagk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: drhomagk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengvsmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengvsmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dforce.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dforce.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dforcek.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dforcek.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dforcek.f90: In function 'dforcek_': dforcek.f90:30:51: warning: 'devecsv.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 30 | complex(8), allocatable :: evecsv(:,:),devecsv(:,:) | ^ dforcek.f90:30:51: warning: 'devecsv.offset' may be used uninitialized [-Wmaybe-uninitialized] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynqtor.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynqtor.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynevs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynevs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phonon.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phonon.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined phonon.f90:119:41: 80 | call mixerifc(mtype,nmix,dvsbs,ddv,nwork,dvsbs) | 2 ...... 119 | call mixerifc(mtype,nmix,dvsbs,ddv,nwork,work) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/COMPLEX(8)). phonon.f90:255:17: 210 | call mpi_bcast(devalfv(:,:,ik),n,mpi_double_precision,lp,mpicom,ierror) | 2 ...... 255 | call mpi_bcast(tlast,1,mpi_logical,0,mpicom,ierror) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (LOGICAL(4)/REAL(8)). gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynrtoq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynrtoq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mcmillan.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mcmillan.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genephmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genephmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengkqvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengkqvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genmcph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genmcph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putdevecfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putdevecfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getdevecfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getdevecfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putdevecsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putdevecsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getdevecsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getdevecsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phononsc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phononsc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genscph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genscph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phdisp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phdisp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynsymapp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynsymapp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynsym.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynsym.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynev.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynev.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phdos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phdos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sumrule.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sumrule.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writephn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writephn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynfext.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynfext.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegamma.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegamma.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readgamma.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readgamma.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phlwidth.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phlwidth.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c alpha2f.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: alpha2f.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writelambda.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writelambda.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ephcouple.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ephcouple.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eliashberg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eliashberg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phscdvs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phscdvs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readdvs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readdvs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readalpha2f.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readalpha2f.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendsocfr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendsocfr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bornechg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bornechg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bectask.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bectask.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c becfext.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: becfext.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putephmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putephmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getephmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getephmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_pzca.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_pzca.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_pwca.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_pwca.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_pbe.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_pbe.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_am05.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_am05.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_xalpha.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_xalpha.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_wc06.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_wc06.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c x_wc06.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: x_wc06.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c x_pbe.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: x_pbe.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c c_pbe.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: c_pbe.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c c_pbe_gcor.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: c_pbe_gcor.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_vbh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_vbh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fxc_pwca.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fxc_pwca.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c k_tfvw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: k_tfvw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c k_tfvw_sp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: k_tfvw_sp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c k_tfvw1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: k_tfvw1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c k_vwlb.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: k_vwlb.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendmatmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendmatmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genveedu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genveedu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tm2todm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tm2todm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tm3todm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tm3todm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmtotm3.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmtotm3.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writedftu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writedftu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sbesseli.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sbesseli.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c shankeli.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: shankeli.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genfdu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genfdu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genfdufr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genfdufr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c engyfdu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: engyfdu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findlambda.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findlambda.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vmatmtsc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vmatmtsc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvmatmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvmatmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vmatmtdu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vmatmtdu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vmatmtftm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vmatmtftm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fyukawa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fyukawa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fyukawa0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fyukawa0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readdmatmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readdmatmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetm3.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetm3.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendmftm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendmftm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeftm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeftm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetm3td.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetm3td.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwkpr0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwkpr0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tm3rtoz.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tm3rtoz.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmft.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmft.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmwriteengy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmwriteengy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmminc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmminc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmvaryc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmvaryc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdedc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdedc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmengyxc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmengyxc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rdmengyxc.f90: In function 'rdmengyxc_': rdmengyxc.f90:73:45: warning: 't2' may be used uninitialized [-Wmaybe-uninitialized] 73 | engyx=engyx-t2*vclijji(ist2,ist1,ik2) | ^ rdmengyxc.f90:24:13: note: 't2' was declared here 24 | real(8) t1,t2,t3,t4 | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmminn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmminn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmvaryn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmvaryn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdkdc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdkdc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmenergy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmenergy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmwritededn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmwritededn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdedn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdedn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdexcdn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdexcdn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rdmdexcdn.f90: In function 'rdmdexcdn_': rdmdexcdn.f90:77:63: warning: 't2' may be used uninitialized [-Wmaybe-uninitialized] 77 | dedn(ist2,ik2)=dedn(ist2,ik2)+t2*vclijji(ist2,ist1,ik2) | ^ rdmdexcdn.f90:31:13: note: 't2' was declared here 31 | real(8) t1,t2,t3,t4 | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvclijjk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvclijjk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getvclijji.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getvclijji.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getvclijjk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getvclijjk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writevclijji.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writevclijji.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writevclijjk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writevclijjk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdexcdc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdexcdc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rdmdexcdc.f90: In function 'rdmdexcdc_': rdmdexcdc.f90:80:40: warning: 't2' may be used uninitialized [-Wmaybe-uninitialized] 80 | vclijjk(ist1,ist3,ist4,ik2) | ^ rdmdexcdc.f90:29:13: note: 't2' was declared here 29 | real(8) t1,t2,t3 | ^ gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdtsdn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdtsdn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmentropy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmentropy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmeval.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmeval.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvclijji.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvclijji.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwdmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwdmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwlocal.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwlocal.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwgw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwgw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ksinvert.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ksinvert.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gtwsum.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gtwsum.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c minf_nm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: minf_nm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c acpole.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: acpole.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwrhomag.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwrhomag.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwdmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwdmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwefermi.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwefermi.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dysonr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dysonr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwsefm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwsefm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putgwsefm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putgwsefm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getgwsefm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getgwsefm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeigw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeigw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c polefit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: polefit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwchgk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwchgk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwsefmk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwsefmk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwspecf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwspecf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegwsf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegwsf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c acgwse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: acgwse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fmin_nm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fmin_nm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfpole.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfpole.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwbandstr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwbandstr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwscrho.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwscrho.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c atptstep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: atptstep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potkst.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potkst.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tdbackup.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tdbackup.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetimes.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetimes.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readtimes.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readtimes.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentimes.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentimes.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readafieldt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readafieldt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tddft.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tddft.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c timestep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: timestep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined timestep.f90:126:34: 124 | call mpi_allreduce(mpi_in_place,engykn,1,mpi_double_precision,mpi_sum,mpicom,& | 2 125 | ierror) 126 | call mpi_allreduce(mpi_in_place,jtot,3,mpi_double_precision,mpi_sum,mpicom, & | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tddftlr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tddftlr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genhmlt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genhmlt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetddos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetddos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeafpdt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeafpdt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readafindt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readafindt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvfxc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvfxc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genfxcr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genfxcr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genfxcr.f90: In function 'genfxcr_': genfxcr.f90:18:57: warning: 'mag.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 18 | real(8), allocatable :: rho(:),rhoup(:),rhodn(:),mag(:,:) | ^ genfxcr.f90:18:57: warning: 'mag.offset' may be used uninitialized [-Wmaybe-uninitialized] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tdtemp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tdtemp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetdlsj.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetdlsj.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genspfxcr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genspfxcr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvfxcg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvfxcg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tddftsplr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tddftsplr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genspfxcg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genspfxcg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genafieldt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genafieldt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetddft.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetddft.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dielectric_tdrt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dielectric_tdrt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readjtot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readjtot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c afindtstep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: afindtstep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genefieldt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genefieldt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c energytd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: energytd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c engyknk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: engyknk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readforcet.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readforcet.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tdrestart.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tdrestart.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readdatposc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readdatposc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writedatposc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writedatposc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhostatic.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhostatic.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c jtotk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: jtotk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhosplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhosplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bornecdyn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bornecdyn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c becforce.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: becforce.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfirctof.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfirctof.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevalu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevalu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writekpa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writekpa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genhdbulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genhdbulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vblocalu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vblocalu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c chargeu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: chargeu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c addbfsmu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: addbfsmu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c momentu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: momentu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c occupyulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: occupyulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potksu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potksu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writevclr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writevclr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzvmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzvmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genzvmatk.f90:48:19: 48 | wfmt1(1:npc)=zvmt(1:npc,ias)*wfmt(1:npc,ias,ispn,jst) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzvbmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzvbmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genzvbmatk.f90:161:10: 161 | wf21(i)=(zv(i)+zb(i))*wf11(i) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genzvbmatk.f90:162:10: 162 | wf22(i)=(zv(i)-zb(i))*wf12(i) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genzvbmatk.f90:131:10: 131 | wf21(i)=(zv(i)+zb3(i))*wf11(i)+(zb1(i)-z1)*wf12(i) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genzvbmatk.f90:132:10: 132 | wf22(i)=(zv(i)-zb3(i))*wf12(i)+(zb1(i)+z1)*wf11(i) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomagq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomagq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeengyu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeengyu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfzfftq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfzfftq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rfzfftq.f90:113:36: 68 | call mpi_allreduce(mpi_in_place,zfmt,n,mpi_double_complex,mpi_sum,mpicom, & | 2 ...... 113 | call mpi_allreduce(mpi_in_place,rfmt,n,mpi_double_precision,mpi_sum, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/COMPLEX(8)). gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhocoreu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhocoreu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomaguk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomaguk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genhmlu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genhmlu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potxcu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potxcu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeinfou.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeinfou.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vclqinit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vclqinit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writechgrmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writechgrmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c initulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: initulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writemomrmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writemomrmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writestulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writestulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readstulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readstulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potefieldu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potefieldu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c puthdbulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: puthdbulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gethdbulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gethdbulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potuinit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potuinit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readvclr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readvclr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genkpakq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genkpakq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotu1d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotu1d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotu2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotu2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotu3d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotu3d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gndstulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gndstulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gndstulr.f90:79:42: 75 | call mixerifc(mixtype,nmix,vsbsq,dv,nwork,vsbsq) | 2 ...... 79 | call mixerifc(mixtype,nmix,vsbsq,dv,nwork,work) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/COMPLEX(8)). gndstulr.f90:242:17: 150 | call mpi_bcast(evalu(:,ik0),nstulr,mpi_double_precision,lp,mpicom,ierror) | 2 ...... 242 | call mpi_bcast(tlast,1,mpi_logical,0,mpicom,ierror) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (LOGICAL(4)/REAL(8)). gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potuplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potuplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potcoulu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potcoulu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhouplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhouplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c maguplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: maguplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c initw90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: initw90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90win.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90win.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90eig.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90eig.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c setupw90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: setupw90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90mmn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90mmn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90spn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90spn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmatuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmatuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dmatuv.f90:21:8: 21 | vn(i)=dot_product(v(:,i),v(:,i)) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to REAL(8) at (1) [-Wconversion] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmatwx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmatwx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dmatwx.f90:19:8: 19 | xn(i)=dot_product(x(:,i),x(:,i)) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to REAL(8) at (1) [-Wconversion] gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnwxy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnwxy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevaluv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevaluv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c occupyuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: occupyuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevaluv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevaluv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevaluv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevaluv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevecuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevecuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevecuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevecuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevecwxy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevecwxy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevecwxy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevecwxy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevalwx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevalwx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevalwx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevalwx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c aceplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: aceplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevalwx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevalwx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -o elk modmain.o mpi_stub.o modmpi.o modramdisk.o libxcf90.o libxcifc.o modxcifc.o modfxcifc.o moddftu.o modrdm.o modphonon.o modtest.o modrandom.o modstore.o modpw.o modvars.o modtddft.o modgw.o modulr.o modbog.o moddelf.o modomp.o mkl_stub.o mkl_init.o oblas_init.o blis_stub.o blis_init.o w90_stub.o modw90.o zfftifc_fftw.o elk.o r3mm.o r3mtm.o r3mmt.o r3vo.o gengvec.o wigner3j.o gengvc.o potnucl.o zfmtint.o rfmtint.o genvsig.o rfmtinp.o findngkmax.o potks.o mtdmin.o rfcopy.o rhomagv.o eveqn.o genffacgp.o unitary.o zmdet.o rfmtftoc.o zminv.o symrf.o genvmat.o writeeval.o mixerifc.o splinew.o nfftifc.o symdmat.o z2mm.o z2mctm.o z2mmct.o axangsu2.o gradzvcln.o gentpmae.o zfcmtwr.o projsbf.o gradzf.o timesec.o zfmtftoc.o ztorfmt.o zfmtctof.o eveqnfvz.o energynn.o gaunt.o potxcmt.o sdelta_mp.o stheta_mp.o sdelta_fd.o stheta_fd.o writelsj.o eveqnzh.o gensmatk.o gensfacgp.o rhomag.o wsplintp.o checkmt.o reciplat.o gradrf.o genzfrm.o mixadapt.o zftrf.o sbessel.o gengclgq.o gencfun.o factr.o genstress.o force.o genvbmatk.o forcek.o writeepsinv.o olprad.o polark.o zfmtinp.o hflocal.o mixbroyden.o grad2rfmt.o clebgor.o rfirctof.o effmass.o zpotcoul.o sfacmag.o polynm.o epsinv.o rfinpc.o zmctmu.o zmctm.o writeiad.o genapwfr.o gengclq.o addbfsm.o genylmv.o olpfv.o hmlfv.o genexpmt.o rfinp.o factnm.o sphcover.o sctovec.o genppts.o eveqnzg.o fderiv.o genpmat.o genexpmat.o writeforces.o r3cross.o match.o genspchi0.o genzrho.o potefield.o rhoinit.o eveqnsv.o roteuler.o genrmesh.o splint.o wavefcr.o lopzflm.o brzint.o rotdmat.o genylmg.o gentaucr.o readinput.o numlist.o hermite.o genfspecies.o atpstep.o dmatls.o writeengy.o writechg.o rbsht.o rfsht.o genlofr.o rotrfmt.o zftzf.o genpmatk.o rvfcross.o writeinfo.o mossbauer.o initoep.o i3minv.o r3mv.o genidxlo.o nuclei.o writeefg.o writeevsp.o gencore.o r3mtv.o r3minv.o r3frac.o genapwlofr.o gridsize.o symrfir.o geomplot.o ylmroty.o gengvclns.o ssfext.o writestate.o sdelta_sq.o potxcir.o potxc.o rzfmtinp.o rhoplot.o occupy.o symveca.o jprplot.o genvmatk.o geomopt.o eveqnss.o hartfock.o potplot.o genwfpw.o hmlxbse.o hmlxbsek.o hmldbse.o hmldbsek.o gradwfcr2.o oepresk.o addlorbcnd.o energy.o wfplot.o oepvcl.o oepvclk.o polar.o dbxcplot.o sbesseldm.o writehmlbse.o dielectric_bse.o vecplot.o nesting.o writeevbse.o emdplot3d.o emdplot2d.o emdplot1d.o rfhkintp.o writewfpw.o vblocal.o writefsm.o getwfpw.o plotpt1d.o init1.o init2.o findsymcrys.o plotpt3d.o elnes.o fermisurfbxsf.o genspecies.o writeexpmat.o writekpts.o wfcrplot.o writedos.o energykncr.o ggamt_1.o ggair_1.o ggamt_sp_1.o ggair_sp_1.o ggamt_2a.o ggair_2a.o ggamt_2b.o ggair_2b.o ggamt_sp_2a.o ggair_sp_2a.o ggamt_sp_2b.o ggair_sp_2b.o writeemd.o reademd.o emdplot.o init3.o init4.o bfieldfsm.o testcheck.o pade.o wsplint.o gensocfr.o pades.o genscss.o rfcmtwr.o nonlinopt.o writelat.o rhocore.o rzfinp.o readspecies.o findband.o exxengy.o gentauk.o gradrfmt.o checkfsm.o genrlmv.o mae.o writegvecrf.o zcfmtwr.o wfmtsv.o olpistl.o hmlistl.o olpalo.o hmlalo.o olplolo.o hmllolo.o olpaa.o hmlaa.o gengclg.o rhomagsh.o charge.o moment.o rfint0.o r3mdet.o gencfrc.o checkstop.o genbs.o rfirsm.o rfmtsm.o rfint.o gradwf2.o closefiles.o writelinen.o rfmtlm.o putpmat.o getpmat.o rfmtpack.o zfmtpack.o putevalfv.o getevalfv.o wfmtfv.o putkmat.o getkmat.o putepsinv.o getcfgq.o putevalsv.o getevalsv.o getevecsv.o putevecsv.o genshtmat.o allatoms.o putevecfv.o getevecfv.o writesym.o putoccsv.o getoccsv.o torque.o findqpt.o findkpt.o genevfsv.o genwfsv.o sdelta.o stheta.o sortidx.o symmat.o radnucl.o symrvf.o writeqpts.o rndevsv.o gengkvec.o mixlinear.o writesf.o gengqf.o genkmat.o genolpq.o genjlgprmt.o rfinterp.o fsmooth.o axangrot.o rotaxang.o wspline.o splined.o findswidth.o findsymlat.o writepmat.o genstrain.o symmetry.o linengy.o writestress.o eulerrot.o zftwfir.o rschrodint.o writegclq.o writegeom.o writemom.o gendmat.o curlrvf.o genzvclmt.o genjtot.o symvec.o checkwrite.o genjprk.o proj2d.o genidxbse.o symrvfir.o genjpr.o eveqnfvr.o gentau.o genjlgpr.o writestrain.o writefermi.o rfmtctof.o findsym.o zfsht.o rhonorm.o genvchi0.o zfmtconj.o stheta_sq.o sdelta_lr.o stheta_lr.o findsymsite.o genlmirep.o writespecies.o rhomagk.o symrvfmt.o wigner3jf.o genhvec.o ylmrot.o wxcplot.o massnucl.o gendmatk.o rfplot.o straingkq.o eveqnit.o oepmain.o rdirac.o bandstr.o sfacinit.o findscq.o plot1d.o plot2d.o plot3d.o init0.o readstate.o eveqnhf.o zbsht.o i3mtv.o spline.o gauntyry.o findnjcmax.o gndstate.o sstask.o fermisurf.o spiralsc.o atom.o maginit.o exxengyk.o xc_c_tb09.o moke.o hmlrad.o dos.o findprimcell.o plotpt2d.o sfacrho.o bdipole.o dielectric.o elfplot.o vclcore.o zfmtwr.o zvcldisp.o vecfbz.o gcd.o lopzflmn.o zpotclmt.o readfermi.o gensdmat.o symrfmt.o sphcrd.o potcoul.o genzrm.o rminv.o rtozfmt.o genwfsvp.o rdiracint.o rotzflm.o zfinp.o latvstep.o gradzfmt.o eveqnfv.o cbsht.o cfsht.o wfmtsv_sp.o wfirsv.o genwfsv_sp.o ggamt_4.o ggair_4.o trzhmm.o rvcopy.o dolpistl.o dhmlistl.o olpaloq.o hmlaloq.o dolpalo.o dhmlalo.o dhmllolo.o olpaaq.o dolpaa.o dhmlaa.o hmlaaq.o initeph.o dengyeph.o gndsteph.o eveqneph.o hmlepha.o hmlephb.o hmlephde.o getephmkq.o ephdos.o gradrhomt.o gendcfun.o gendvsig.o drhomagsh.o doccupy.o dhmlrad.o gendwfsv.o dwfmtfv.o gengqvec.o dmatch.o writedvs.o readdyn.o dyntask.o dpotks.o dpotxc.o deveqnfv.o dpotcoul.o drhomagk.o gengvsmt.o dforce.o dforcek.o dynqtor.o dynevs.o phonon.o dynrtoq.o mcmillan.o genephmat.o gengkqvec.o genmcph.o putdevecfv.o getdevecfv.o putdevecsv.o getdevecsv.o phononsc.o genscph.o phdisp.o dynsymapp.o dynsym.o dynev.o phdos.o sumrule.o writephn.o dynfext.o writegamma.o readgamma.o phlwidth.o alpha2f.o writelambda.o ephcouple.o eliashberg.o phscdvs.o readdvs.o readalpha2f.o gendsocfr.o bornechg.o bectask.o becfext.o putephmat.o getephmat.o xc_pzca.o xc_pwca.o xc_pbe.o xc_am05.o xc_xalpha.o xc_wc06.o x_wc06.o x_pbe.o c_pbe.o c_pbe_gcor.o xc_vbh.o fxc_pwca.o k_tfvw.o k_tfvw_sp.o k_tfvw1.o k_vwlb.o gendmatmt.o genveedu.o tm2todm.o tm3todm.o dmtotm3.o writedftu.o sbesseli.o shankeli.o genfdu.o genfdufr.o engyfdu.o findlambda.o vmatmtsc.o genvmatmt.o vmatmtdu.o vmatmtftm.o fyukawa.o fyukawa0.o readdmatmt.o writetm.o writetm3.o gendmftm.o writeftm.o writetm3td.o genwkpr0.o tm3rtoz.o rdmft.o rdmwriteengy.o rdmminc.o rdmvaryc.o rdmdedc.o rdmengyxc.o rdmminn.o rdmvaryn.o rdmdkdc.o rdmenergy.o rdmwritededn.o rdmdedn.o rdmdexcdn.o genvclijjk.o getvclijji.o getvclijjk.o writevclijji.o writevclijjk.o rdmdexcdc.o rdmdtsdn.o rdmentropy.o rdmeval.o genvclijji.o gwdmat.o gwlocal.o genwgw.o ksinvert.o gtwsum.o minf_nm.o acpole.o gwrhomag.o gwdmatk.o gwefermi.o dysonr.o gwsefm.o putgwsefm.o getgwsefm.o writeigw.o polefit.o gwchgk.o gwsefmk.o gwspecf.o writegwsf.o acgwse.o fmin_nm.o zfpole.o gwbandstr.o gwscrho.o atptstep.o potkst.o tdbackup.o writetimes.o readtimes.o gentimes.o readafieldt.o genjr.o tddft.o timestep.o tddftlr.o genhmlt.o writetddos.o writeafpdt.o readafindt.o genvfxc.o genfxcr.o tdtemp.o writetdlsj.o genspfxcr.o genvfxcg.o tddftsplr.o genspfxcg.o genafieldt.o writetddft.o dielectric_tdrt.o readjtot.o afindtstep.o genefieldt.o energytd.o engyknk.o readforcet.o tdrestart.o readdatposc.o writedatposc.o rhostatic.o jtotk.o rhosplot.o bornecdyn.o becforce.o zfirctof.o writeevalu.o writekpa.o genhdbulr.o vblocalu.o chargeu.o addbfsmu.o momentu.o occupyulr.o potksu.o writevclr.o genzvmatk.o genzvbmatk.o rhomagq.o writeengyu.o rfzfftq.o rhocoreu.o eveqnulr.o rhomaguk.o genhmlu.o potxcu.o writeinfou.o zfplot.o vclqinit.o writechgrmt.o initulr.o writemomrmt.o writestulr.o readstulr.o potefieldu.o puthdbulr.o gethdbulr.o potuinit.o readvclr.o genkpakq.o plotu1d.o plotu2d.o plotu3d.o gndstulr.o plotulr.o potuplot.o potcoulu.o rhouplot.o maguplot.o initw90.o writew90.o writew90win.o writew90eig.o setupw90.o writew90mmn.o writew90spn.o dmatuv.o dmatwx.o eveqnuv.o eveqnwxy.o writeevaluv.o occupyuv.o genwfuv.o putevaluv.o getevaluv.o putevecuv.o getevecuv.o putevecwxy.o getevecwxy.o putevalwx.o getevalwx.o aceplot.o writeevalwx.o -L/usr/lib64 -lflexiblas -L/usr/lib64 -lfftw3 \ -L/usr/lib64 -lxc -lxcf90 fmin_nm.f90:15:23: warning: type of 'polefit' does not match original declaration [-Wlto-type-mismatch] 15 | fmin_nm=polefit(rd,x) | ^ polefit.f90:6:24: note: 'polefit' was previously declared here 6 | real(8) function polefit(zfm,c) | ^ polefit.f90:6:24: note: code may be misoptimized unless '-fno-strict-aliasing' is used acpole.f90:64:31: warning: type of 'zfpole' does not match original declaration [-Wlto-type-mismatch] 64 | zr(iw)=zfpole(x(:,1),zwr(iw)) | ^ zfpole.f90:6:31: note: 'zfpole' was previously declared here 6 | pure complex(8) function zfpole(c,z) | ^ zfpole.f90:6:31: note: code may be misoptimized unless '-fno-strict-aliasing' is used acpole.f90:30:38: warning: type of 'minf_nm' does not match original declaration [-Wlto-type-mismatch] 30 | call minf_nm(1,zm,n2,x,maxit,iter,eps) | ^ minf_nm.f90:6:18: note: 'minf_nm' was previously declared here 6 | subroutine minf_nm(id,rd,n,x,maxit,iter,eps) | ^ minf_nm.f90:6:18: note: code may be misoptimized unless '-fno-strict-aliasing' is used findsymsite.f90:29:75: warning: type of 'findsym' does not match original declaration [-Wlto-type-mismatch] 29 | call findsym(apl,apl,nsymsite(ias),lsplsyms(:,ias),lspnsyms(:,ias),iea) | ^ findsym.f90:9:18: note: 'findsym' was previously declared here 9 | subroutine findsym(apl1,apl2,nsym,lspl,lspn,iea) | ^ findsym.f90:9:18: note: code may be misoptimized unless '-fno-strict-aliasing' is used chargeu.f90:36:34: warning: type of 'ddot' does not match original declaration [-Wlto-type-mismatch] 36 | t1=ddot(ngtc,rhoqir(:,1),2,cfrc,1) | ^ zmctmu.f90:29:46: note: 'ddot' was previously declared here 29 | c(i,j)=c(i,j)+ddot(l2,a(:,i),1,b(:,j),1) | ^ zmctmu.f90:29:46: note: code may be misoptimized unless '-fno-strict-aliasing' is used gndsteph.f90:42:48: warning: type of 'mixerifc' does not match original declaration [-Wlto-type-mismatch] 42 | call mixerifc(mixtype,nmix,duvwx,dv,nwork,duvwx) | ^ mixerifc.f90:6:19: note: 'mixerifc' was previously declared here 6 | subroutine mixerifc(mtype,n,v,dv,nwork,work) | ^ mixerifc.f90:6:19: note: code may be misoptimized unless '-fno-strict-aliasing' is used modramdisk.f90:264:47: warning: type of 'rvcopy' does not match original declaration [-Wlto-type-mismatch] 264 | call rvcopy(3,file(fnum)%rec(irec)%dat(i),v1) | ^ modramdisk.f90:189:47: warning: type of 'rvcopy' does not match original declaration [-Wlto-type-mismatch] 189 | call rvcopy(3,v1,file(fnum)%rec(irec)%dat(i)) | ^ rvcopy.f90:6:22: note: 'rvcopy' was previously declared here 6 | pure subroutine rvcopy(n,x,y) | ^ rvcopy.f90:6:22: note: code may be misoptimized unless '-fno-strict-aliasing' is used rhomagv.f90:98:10: warning: type of 'mpi_allreduce' does not match original declaration [-Wlto-type-mismatch] 98 | ierror) | ^ epsinv.f90:58:12: warning: type of 'mpi_allreduce' does not match original declaration [-Wlto-type-mismatch] 58 | ierror) | ^ polar.f90:74:12: warning: type of 'mpi_allreduce' does not match original declaration [-Wlto-type-mismatch] 74 | ierror) | ^ writehmlbse.f90:85:19: warning: type of 'mpi_allreduce' does not match original declaration [-Wlto-type-mismatch] 85 | mpicom,ierror) | ^ mpi_stub.f90:77:24: note: 'mpi_allreduce' was previously declared here 77 | subroutine mpi_allreduce(sendbuf,recvbuf,count,datatype,op,comm,ierror) | ^ mpi_stub.f90:77:24: note: code may be misoptimized unless '-fno-strict-aliasing' is used genvmat.f90:81:70: warning: type of 'mpi_bcast' does not match original declaration [-Wlto-type-mismatch] 81 | call mpi_bcast(vmat(:,:,ik),n,mpi_double_complex,lp,mpicom,ierror) | ^ checkstop.f90:22:51: warning: type of 'mpi_bcast' does not match original declaration [-Wlto-type-mismatch] 22 | call mpi_bcast(tstop,1,mpi_logical,0,mpicom,ierror) | ^ sstask.f90:32:50: warning: type of 'mpi_bcast' does not match original declaration [-Wlto-type-mismatch] 32 | call mpi_bcast(iqss,1,mpi_integer,0,mpicom,ierror) | ^ mpi_stub.f90:66:20: note: 'mpi_bcast' was previously declared here 66 | subroutine mpi_bcast(buffer,count,datatype,root,comm,ierror) | ^ mpi_stub.f90:66:20: note: code may be misoptimized unless '-fno-strict-aliasing' is used make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' cd src/eos; make make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src/eos' gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modmain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modmain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c pveos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: pveos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readinput.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readinput.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getedata.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getedata.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fitdata.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fitdata.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c output.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: output.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c minf_nm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: minf_nm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fmin_nm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fmin_nm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -o eos modmain.o eos.o eveos.o pveos.o readinput.o getedata.o fitdata.o output.o minf_nm.o fmin_nm.o make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src/eos' cd src/spacegroup; make make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src/spacegroup' gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modmain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modmain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c main.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: main.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readinput.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readinput.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gencrystal.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gencrystal.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sgsymb.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sgsymb.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c seitzgen.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: seitzgen.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengroup.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengroup.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c seitzeq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: seitzeq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c seitzmul.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: seitzmul.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegeom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegeom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c geomplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: geomplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findprimcell.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findprimcell.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3frac.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3frac.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3cross.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3cross.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3minv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3minv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gfortran -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -o spacegroup modmain.o main.o readinput.o gencrystal.o sgsymb.o seitzgen.o gengroup.o seitzeq.o seitzmul.o writegeom.o geomplot.o findprimcell.o r3frac.o r3mv.o r3cross.o r3minv.o r3mm.o make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src/spacegroup' + mv src/elk . + mv src/eos/eos elk-eos + mv src/spacegroup/spacegroup elk-spacegroup + /usr/bin/make clean cd src; make cleanall make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' cd BLAS; make clean /bin/sh: line 1: cd: BLAS: No such file or directory make[2]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' rm -f *.o *.mod *~ ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf *.tex *.toc *.out elk make[2]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' cd LAPACK; make clean /bin/sh: line 1: cd: LAPACK: No such file or directory make[2]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' rm -f *.o *.mod *~ ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf *.tex *.toc *.out elk make[2]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' cd fftlib; make clean /bin/sh: line 1: cd: fftlib: No such file or directory make[2]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' rm -f *.o *.mod *~ ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf *.tex *.toc *.out elk make[2]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' make clean make[2]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' rm -f *.o *.mod *~ ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf *.tex *.toc *.out elk make[2]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' cd src/eos; make clean make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src/eos' rm -f *.o *.mod *~ fort.* ifc* *.gcno *.OUT gmon.out eos make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src/eos' cd src/spacegroup; make clean make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src/spacegroup' rm -f *.o *.mod *~ fort.* ifc* *.gcno *.OUT *.xsf *.ascii gmon.out \ *.aux *.dvi *.log *.pdf *.tex *.toc *.out spacegroup make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src/spacegroup' rm -f *.o *.mod *~ fort.* ifc* *.gcno *.exe + rm -rf src + cp -rp src.orig src + . /etc/profile.d/modules.sh ++ . /etc/profile.d/00-modulepath.sh +++ '[' -z /etc/modulefiles:/usr/share/modulefiles:/usr/share/modulefiles/Linux:/usr/share/modulefiles/Core:/usr/share/lmod/lmod/modulefiles/Core ']' +++ : ++ '[' -z '' ']' ++ LMOD_ALLOW_ROOT_USE=yes ++ '[' -n '' ']' ++ '[' yes '!=' yes ']' ++ '[' -z /usr/share/modulefiles ']' ++ findExec READLINK_CMD /usr/bin/readlink readlink ++ Nm=READLINK_CMD ++ confPath=/usr/bin/readlink ++ execNm=readlink ++ eval READLINK_CMD=/usr/bin/readlink +++ READLINK_CMD=/usr/bin/readlink ++ '[' '!' -x /usr/bin/readlink ']' ++ unset Nm confPath execNm ++ findExec PS_CMD /usr/bin/ps ps ++ Nm=PS_CMD ++ confPath=/usr/bin/ps ++ execNm=ps ++ eval PS_CMD=/usr/bin/ps +++ PS_CMD=/usr/bin/ps ++ '[' '!' -x /usr/bin/ps ']' ++ unset Nm confPath execNm ++ findExec EXPR_CMD /usr/bin/expr expr ++ Nm=EXPR_CMD ++ confPath=/usr/bin/expr ++ execNm=expr ++ eval EXPR_CMD=/usr/bin/expr +++ EXPR_CMD=/usr/bin/expr ++ '[' '!' -x /usr/bin/expr ']' ++ unset Nm confPath execNm ++ findExec BASENAME_CMD /usr/bin/basename basename ++ Nm=BASENAME_CMD ++ confPath=/usr/bin/basename ++ execNm=basename ++ eval BASENAME_CMD=/usr/bin/basename +++ BASENAME_CMD=/usr/bin/basename ++ '[' '!' -x /usr/bin/basename ']' ++ unset Nm confPath execNm ++ unset -f findExec ++ '[' -f /proc/50/exe ']' +++ /usr/bin/readlink /proc/50/exe ++ my_shell=/usr/bin/bash +++ /usr/bin/expr /usr/bin/bash : '-*\(.*\)' ++ my_shell=/usr/bin/bash +++ /usr/bin/basename /usr/bin/bash ++ my_shell=bash ++ case ${my_shell} in ++ '[' -f /usr/share/lmod/lmod/init/bash ']' ++ . /usr/share/lmod/lmod/init/bash +++ '[' -z '' ']' +++ case "$-" in +++ __lmod_vx=x +++ '[' -n x ']' +++ set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for this output (/usr/share/lmod/lmod/init/bash) Shell debugging restarted +++ unset __lmod_vx ++ unset my_shell PS_CMD EXPR_CMD BASENAME_CMD MODULEPATH_INIT LMOD_ALLOW_ROOT_USE READLINK_CMD + module load mpi/openmpi-ppc64le + local __lmod_my_status + local __lmod_sh_dbg + '[' -z '' ']' + case "$-" in + __lmod_sh_dbg=x + '[' -n x ']' + set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for Lmod's output Shell debugging restarted + return 0 + export PRTE_MCA_rmaps_default_mapping_policy=:oversubscribe + PRTE_MCA_rmaps_default_mapping_policy=:oversubscribe + cp -p make.inc.common make.inc + /usr/bin/sed -i 's|F90 =.*|F90 = mpif90 -fopenmp -fallow-argument-mismatch|' make.inc + /usr/bin/sed -i 's|F77 =.*|F77 = mpif77 -fopenmp -fallow-argument-mismatch|' make.inc + /usr/bin/sed -i 's|F90_OPTS =|F90_OPTS = -I/usr/lib64/gfortran/modules/openmpi|' make.inc + echo 'SRC_MPI =' + cat make.inc SRC_MPI = mpi_stub.f90 F90 = mpif90 -fopenmp -fallow-argument-mismatch F77 = mpif77 -fopenmp -fallow-argument-mismatch F90_OPTS = -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection F77_OPTS = $(F90_OPTS) AR = ar SRC_MKL = mkl_stub.f90 SRC_BLIS = blis_stub.f90 SRC_W90S = w90_stub.f90 LIB_LPK = -L/usr/lib64 -lflexiblas LIB_FFT = -L/usr/lib64 -lfftw3 SRC_FFT = zfftifc_fftw.f90 LIB_libxc = -L/usr/lib64 -lxc -lxcf90 SRC_libxc = libxcf90.f90 libxcifc.f90 SRC_MPI = + cp -p make.inc make.inc_openmpi + /usr/bin/make cd src; make all make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modmain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modmain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modmpi.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modmpi.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modramdisk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modramdisk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined modramdisk.f90:282:48: 264 | call rvcopy(3,file(fnum)%rec(irec)%dat(i),v1) | 2 ...... 282 | call rvcopy(2*nzv,file(fnum)%rec(irec)%dat(i),zva) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/REAL(8)). modramdisk.f90:189:16: 189 | call rvcopy(3,v1,file(fnum)%rec(irec)%dat(i)) | 1 ...... 264 | call rvcopy(3,file(fnum)%rec(irec)%dat(i),v1) | 2 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/INTEGER(4)). mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c libxcf90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: libxcf90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined libxcf90.f90:2212:26: 2212 | subroutine c_to_f_string(c_string, f_string) | ^ Warning: 'c_to_f_string' defined but not used [-Wunused-function] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c libxcifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: libxcifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modxcifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modxcifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modfxcifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modfxcifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c moddftu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: moddftu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modrdm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modrdm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modphonon.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modphonon.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modtest.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modtest.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modrandom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modrandom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modstore.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modstore.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modpw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modpw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modvars.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modvars.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modtddft.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modtddft.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modgw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modgw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modbog.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modbog.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c moddelf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: moddelf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modomp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modomp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mkl_stub.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mkl_stub.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mkl_stub.f90:8:42: 8 | subroutine mkl_set_num_threads(num_threads) | 1 Warning: Unused dummy argument 'num_threads' at (1) [-Wunused-dummy-argument] mkl_stub.f90:13:54: 13 | integer function mkl_set_num_threads_local(num_threads) | 1 Warning: Unused dummy argument 'num_threads' at (1) [-Wunused-dummy-argument] mkl_stub.f90:19:34: 19 | subroutine mkl_set_dynamic(dynamic) | 1 Warning: Unused dummy argument 'dynamic' at (1) [-Wunused-dummy-argument] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mkl_init.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mkl_init.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oblas_init.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oblas_init.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c blis_stub.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: blis_stub.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined blis_stub.f90:8:49: 8 | subroutine bli_thread_set_num_threads(num_threads) | 1 Warning: Unused dummy argument 'num_threads' at (1) [-Wunused-dummy-argument] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c blis_init.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: blis_init.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c w90_stub.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: w90_stub.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined w90_stub.f90:10:31: 10 | num_atoms_loc,atom_symbols_loc,atoms_cart_loc, gamma_only_loc,spinors_loc, & | 1 Warning: Unused dummy argument 'atom_symbols_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:10:46: 10 | num_atoms_loc,atom_symbols_loc,atoms_cart_loc, gamma_only_loc,spinors_loc, & | 1 Warning: Unused dummy argument 'atoms_cart_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:43: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'exclude_bands_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:10:62: 10 | num_atoms_loc,atom_symbols_loc,atoms_cart_loc, gamma_only_loc,spinors_loc, & | 1 Warning: Unused dummy argument 'gamma_only_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:9:48: 9 | real_lattice_loc,recip_lattice_loc,kpt_latt_loc,num_bands_tot, & | 1 Warning: Unused dummy argument 'kpt_latt_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:8:47: 8 | subroutine wannier_setup(seed__name,mp_grid_loc,num_kpts_loc, & | 1 Warning: Unused dummy argument 'mp_grid_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:32: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'nncell_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:21: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'nnlist_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:10: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'nntot_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:46: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'num_bands_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:59: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'num_wann_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:25: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_l_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:36: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_m_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:52: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_radial_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:54: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'proj_s_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:71: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'proj_s_qaxis_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:14: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_site_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:11: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'proj_x_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:63: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_z_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:25: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'proj_zona_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:9:17: 9 | real_lattice_loc,recip_lattice_loc,kpt_latt_loc,num_bands_tot, & | 1 Warning: Unused dummy argument 'real_lattice_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:9:35: 9 | real_lattice_loc,recip_lattice_loc,kpt_latt_loc,num_bands_tot, & | 1 Warning: Unused dummy argument 'recip_lattice_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:8:35: 8 | subroutine wannier_setup(seed__name,mp_grid_loc,num_kpts_loc, & | 1 Warning: Unused dummy argument 'seed__name' at (1) [-Wunused-dummy-argument] w90_stub.f90:10:74: 10 | num_atoms_loc,atom_symbols_loc,atoms_cart_loc, gamma_only_loc,spinors_loc, & | 1 Warning: Unused dummy argument 'spinors_loc' at (1) [-Wunused-dummy-argument] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modw90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modw90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfftifc_fftw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfftifc_fftw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c elk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: elk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mtm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mtm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3vo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3vo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wigner3j.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wigner3j.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengvc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengvc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potnucl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potnucl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvsig.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvsig.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findngkmax.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findngkmax.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potks.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potks.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mtdmin.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mtdmin.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mtdmin.f90: In function 'mtdmin_': mtdmin.f90:67:17: warning: 'rm' may be used uninitialized [-Wmaybe-uninitialized] 67 | dmin=sqrt(d2m)-rm | ^ mtdmin.f90:30:22: note: 'rm' was declared here 30 | real(8) d2,d2m,r,r2,rm,dr,drm | ^ mtdmin.f90:67:17: warning: 'd2m' may be used uninitialized [-Wmaybe-uninitialized] 67 | dmin=sqrt(d2m)-rm | ^ mtdmin.f90:30:14: note: 'd2m' was declared here 30 | real(8) d2,d2m,r,r2,rm,dr,drm | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfcopy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfcopy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomagv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomagv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genffacgp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genffacgp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c unitary.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: unitary.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zmdet.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zmdet.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtftoc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtftoc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zminv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zminv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeeval.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeeval.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mixerifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mixerifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c splinew.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: splinew.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c nfftifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: nfftifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symdmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symdmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c z2mm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: z2mm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c z2mctm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: z2mctm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c z2mmct.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: z2mmct.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c axangsu2.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: axangsu2.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradzvcln.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradzvcln.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentpmae.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentpmae.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfcmtwr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfcmtwr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c projsbf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: projsbf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradzf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradzf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c timesec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: timesec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtftoc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtftoc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ztorfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ztorfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtctof.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtctof.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnfvz.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnfvz.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c energynn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: energynn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gaunt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gaunt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potxcmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potxcmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined potxcmt.f90: In function 'potxcmt_': potxcmt.f90:33:41: warning: 'bxc.offset' may be used uninitialized [-Wmaybe-uninitialized] 33 | real(8), allocatable :: mag(:,:),bxc(:,:),tau(:,:) | ^ potxcmt.f90:33:41: warning: 'bxc.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] potxcmt.f90:41:45: warning: 'wcdn.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 41 | real(8), allocatable :: wc(:),wcup(:),wcdn(:) | ^ potxcmt.f90:41:29: warning: 'wc.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 41 | real(8), allocatable :: wc(:),wcup(:),wcdn(:) | ^ potxcmt.f90:31:45: warning: 'vxdn.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 31 | real(8), allocatable :: vx(:),vxup(:),vxdn(:) | ^ potxcmt.f90:293:22: warning: 'vc.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 293 | vxc(:)=vx(:)+vc(:) | ^ potxcmt.f90:32:29: note: 'vc.dim[0].ubound' was declared here 32 | real(8), allocatable :: vc(:),vcup(:),vcdn(:) | ^ potxcmt.f90:33:50: warning: 'tau.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 33 | real(8), allocatable :: mag(:,:),bxc(:,:),tau(:,:) | ^ potxcmt.f90:33:50: warning: 'tau.offset' may be used uninitialized [-Wmaybe-uninitialized] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta_mp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta_mp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta_mp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta_mp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta_fd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta_fd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta_fd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta_fd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writelsj.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writelsj.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnzh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnzh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gensmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gensmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gensfacgp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gensfacgp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomag.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomag.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wsplintp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wsplintp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c checkmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: checkmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c reciplat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: reciplat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradrf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradrf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzfrm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzfrm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mixadapt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mixadapt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zftrf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zftrf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sbessel.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sbessel.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengclgq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengclgq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gencfun.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gencfun.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c factr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: factr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genstress.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genstress.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c force.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: force.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined force.f90: In function 'force_': force.f90:84:16: warning: 't2' may be used uninitialized [-Wmaybe-uninitialized] 84 | real(8) ca,t1,t2 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvbmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvbmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genvbmatk.f90:50:17: 50 | wfmt1(1:npc,:)=wfmt(1:npc,ias,1,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genvbmatk.f90:51:22: 51 | wfmt1(npc+1:npc2,:)=wfmt(1:npc,ias,2,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genvbmatk.f90:95:18: 95 | wfmt4(1:npc2)=wfmt2(1:npc2) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c forcek.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: forcek.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined forcek.f90: In function 'forcek_': forcek.f90:42:52: warning: 'evecsv.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 42 | complex(8), allocatable :: evecfv(:,:,:),evecsv(:,:) | ^ forcek.f90:42:52: warning: 'evecsv.offset' may be used uninitialized [-Wmaybe-uninitialized] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeepsinv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeepsinv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olprad.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olprad.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c polark.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: polark.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hflocal.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hflocal.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mixbroyden.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mixbroyden.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c grad2rfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: grad2rfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c clebgor.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: clebgor.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfirctof.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfirctof.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c effmass.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: effmass.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zpotcoul.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zpotcoul.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sfacmag.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sfacmag.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c polynm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: polynm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c epsinv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: epsinv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfinpc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfinpc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zmctmu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zmctmu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zmctm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zmctm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeiad.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeiad.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genapwfr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genapwfr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengclq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengclq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c addbfsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: addbfsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genylmv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genylmv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genexpmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genexpmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c factnm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: factnm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sphcover.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sphcover.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sctovec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sctovec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genppts.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genppts.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnzg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnzg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fderiv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fderiv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genexpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genexpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genexpmat.f90: In function 'genexpmat_': genexpmat.f90:26:39: warning: 'evecsv1.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 26 | complex(8), allocatable :: evecsv1(:,:),evecsv2(:,:) | ^ genexpmat.f90:26:39: warning: 'evecsv1.offset' may be used uninitialized [-Wmaybe-uninitialized] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeforces.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeforces.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3cross.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3cross.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c match.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: match.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genspchi0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genspchi0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzrho.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzrho.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potefield.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potefield.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhoinit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhoinit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined eveqnsv.f90:100:21: 100 | wfmt6(1:npc,ist)=wfmt1(1:npc,ist) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] eveqnsv.f90: In function 'eveqnsv_': eveqnsv.f90:26:10: warning: 'a1' may be used uninitialized [-Wmaybe-uninitialized] 26 | real(8) a1,a2,a3,t1 | ^ eveqnsv.f90:26:13: warning: 'a2' may be used uninitialized [-Wmaybe-uninitialized] 26 | real(8) a1,a2,a3,t1 | ^ eveqnsv.f90:303:25: warning: 'a3' may be used uninitialized [-Wmaybe-uninitialized] 303 | deallocate(wfir1,wfir2) | ^ eveqnsv.f90:26:16: note: 'a3' was declared here 26 | real(8) a1,a2,a3,t1 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c roteuler.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: roteuler.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genrmesh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genrmesh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c splint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: splint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wavefcr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wavefcr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined wavefcr.f90: In function 'wavefcr_': wavefcr.f90:123:16: warning: 'i2' may be used uninitialized [-Wmaybe-uninitialized] 123 | i2=i2+lmmaxo | ^ wavefcr.f90:19:15: note: 'i2' was declared here 19 | integer i,i1,i2 | ^ wavefcr.f90:122:16: warning: 'i1' may be used uninitialized [-Wmaybe-uninitialized] 122 | i1=i1+lmmaxo | ^ wavefcr.f90:19:12: note: 'i1' was declared here 19 | integer i,i1,i2 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c lopzflm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: lopzflm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c brzint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: brzint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rotdmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rotdmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genylmg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genylmg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentaucr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentaucr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readinput.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readinput.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c numlist.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: numlist.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hermite.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hermite.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genfspecies.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genfspecies.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c atpstep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: atpstep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmatls.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmatls.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeengy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeengy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writechg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writechg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rbsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rbsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genlofr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genlofr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rotrfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rotrfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zftzf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zftzf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genpmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genpmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rvfcross.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rvfcross.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeinfo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeinfo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mossbauer.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mossbauer.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c initoep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: initoep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c i3minv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: i3minv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genidxlo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genidxlo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c nuclei.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: nuclei.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeefg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeefg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevsp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevsp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gencore.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gencore.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mtv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mtv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3minv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3minv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3frac.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3frac.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genapwlofr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genapwlofr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gridsize.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gridsize.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrfir.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrfir.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c geomplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: geomplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ylmroty.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ylmroty.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengvclns.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengvclns.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ssfext.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ssfext.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writestate.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writestate.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta_sq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta_sq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potxcir.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potxcir.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined potxcir.f90: In function 'potxcir_': potxcir.f90:26:45: warning: 'vxdn.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 26 | real(8), allocatable :: vx(:),vxup(:),vxdn(:) | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potxc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potxc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rzfmtinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rzfmtinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhoplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhoplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c occupy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: occupy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symveca.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symveca.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c jprplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: jprplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genvmatk.f90:49:19: 49 | wfmt1(1:npc,:)=wfmt(1:npc,ias,ispn,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genvmatk.f90:54:19: 54 | wfmt2(1:npc)=vmt(1:npc,ias)*wfmt(1:npc,ias,ispn,jst) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genvmatk.f90:63:23: 63 | wfmt2(1:npc)=wfmt2(1:npc)+wfmt3(1:npc) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c geomopt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: geomopt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnss.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnss.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined eveqnss.f90: In function 'eveqnss_._omp_fn.0': eveqnss.f90:66:43: warning: 'IMAGPART_EXPR ' may be used uninitialized [-Wmaybe-uninitialized] 66 | if (ssdph.and.(ispn.eq.2)) zq=conjg(zq) | ^ eveqnss.f90:25:13: note: 'IMAGPART_EXPR ' was declared here 25 | complex(8) zq | ^ eveqnss.f90:72:63: warning: 'REALPART_EXPR ' may be used uninitialized [-Wmaybe-uninitialized] 72 | if (ssdph) wfmt1(1:npc,ist,ispn)=zq*wfmt1(1:npc,ist,ispn) | ^ eveqnss.f90:25:13: note: 'REALPART_EXPR ' was declared here 25 | complex(8) zq | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hartfock.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hartfock.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfpw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfpw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlxbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlxbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlxbsek.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlxbsek.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmldbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmldbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmldbsek.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmldbsek.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradwfcr2.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradwfcr2.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oepresk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oepresk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined oepresk.f90:172:50: 172 | call rzadd(npcmt(is),za,zfmt(:,ias),rfmt(:,ias)) | 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) oepresk.f90:174:30: 174 | call rzadd(ngtot,za,zfir,rfir) | 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) oepresk.f90:81:51: 81 | call rzadd(npc,z1,zfmt1,dvxmt(:,ias)) | 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) oepresk.f90:83:65: 83 | call rzadd(npc,z1,zvfmt1(:,idm),dbxmt(:,ias,idm)) | 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) oepresk.f90: In function 'oepresk_': oepresk.f90:26:40: warning: 'zvfmt2.dim[2].stride' may be used uninitialized [-Wmaybe-uninitialized] 26 | complex(8), allocatable :: zvfmt2(:,:,:),zvfir2(:,:) | ^ oepresk.f90:26:52: warning: 'zvfir2.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 26 | complex(8), allocatable :: zvfmt2(:,:,:),zvfir2(:,:) | ^ oepresk.f90:24:47: warning: 'zvfmt1.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 24 | complex(8), allocatable :: zfmt1(:),zvfmt1(:,:) | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c addlorbcnd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: addlorbcnd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c energy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: energy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oepvcl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oepvcl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oepvclk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oepvclk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined oepvclk.f90:98:35: 55 | call genwfsv(.false.,.false.,nstsv,0,ngdgc,igfc,ngk(1,ikp),igkig(:,1,ikp), & | 2 ...... 98 | call genwfsv(.false.,.false.,nst,idx,ngdgc,igfc,ngk(1,ik),igkig(:,1,ik), & | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c polar.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: polar.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dbxcplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dbxcplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sbesseldm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sbesseldm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writehmlbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writehmlbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dielectric_bse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dielectric_bse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vecplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vecplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c nesting.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: nesting.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c emdplot3d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: emdplot3d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c emdplot2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: emdplot2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c emdplot1d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: emdplot1d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfhkintp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfhkintp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rfhkintp.f90: In function 'rfhkintp_': rfhkintp.f90:65:34: warning: 'v0[0]' may be used uninitialized [-Wmaybe-uninitialized] 65 | t2=(vhpl(1)-v0(1))*dble(ngridk(1)) | ^ rfhkintp.f90:20:13: note: 'v0[0]' was declared here 20 | real(8) v0(3),v1(3),v2(3),t1,t2 | ^ rfhkintp.f90:71:34: warning: 'v0[1]' may be used uninitialized [-Wmaybe-uninitialized] 71 | t2=(vhpl(2)-v0(2))*dble(ngridk(2)) | ^ rfhkintp.f90:20:13: note: 'v0[1]' was declared here 20 | real(8) v0(3),v1(3),v2(3),t1,t2 | ^ rfhkintp.f90:75:34: warning: 'v0[2]' may be used uninitialized [-Wmaybe-uninitialized] 75 | t2=(vhpl(3)-v0(3))*dble(ngridk(3)) | ^ rfhkintp.f90:20:13: note: 'v0[2]' was declared here 20 | real(8) v0(3),v1(3),v2(3),t1,t2 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writewfpw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writewfpw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vblocal.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vblocal.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writefsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writefsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getwfpw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getwfpw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotpt1d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotpt1d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init2.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init2.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findsymcrys.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findsymcrys.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined findsymcrys.f90: In function 'findsymcrys_': findsymcrys.f90:39:13: warning: 'v0[0]' may be used uninitialized [-Wmaybe-uninitialized] 39 | real(8) v0(3),v1(3),v2(3),t1 | ^ findsymcrys.f90:39:13: warning: 'v0[1]' may be used uninitialized [-Wmaybe-uninitialized] findsymcrys.f90:195:27: warning: 'v0[2]' may be used uninitialized [-Wmaybe-uninitialized] 195 | v1(:)=atposl(:,1,1)-v0(:) | ^ findsymcrys.f90:39:13: note: 'v0[2]' was declared here 39 | real(8) v0(3),v1(3),v2(3),t1 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotpt3d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotpt3d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c elnes.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: elnes.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fermisurfbxsf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fermisurfbxsf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genspecies.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genspecies.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeexpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeexpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writekpts.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writekpts.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfcrplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfcrplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writedos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writedos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c energykncr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: energykncr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_sp_1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_sp_1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_sp_1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_sp_1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_2a.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_2a.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_2a.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_2a.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_2b.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_2b.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_2b.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_2b.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_sp_2a.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_sp_2a.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_sp_2a.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_sp_2a.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_sp_2b.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_sp_2b.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_sp_2b.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_sp_2b.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeemd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeemd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c reademd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: reademd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c emdplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: emdplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init3.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init3.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init4.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init4.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bfieldfsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bfieldfsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c testcheck.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: testcheck.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c pade.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: pade.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wsplint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wsplint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gensocfr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gensocfr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c pades.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: pades.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genscss.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genscss.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfcmtwr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfcmtwr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c nonlinopt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: nonlinopt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writelat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writelat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhocore.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhocore.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rzfinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rzfinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readspecies.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readspecies.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findband.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findband.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c exxengy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: exxengy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentauk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentauk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradrfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradrfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c checkfsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: checkfsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genrlmv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genrlmv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mae.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mae.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegvecrf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegvecrf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zcfmtwr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zcfmtwr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfmtsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfmtsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpistl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpistl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlistl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlistl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpalo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpalo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlalo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlalo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olplolo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olplolo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmllolo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmllolo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpaa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpaa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlaa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlaa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengclg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengclg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomagsh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomagsh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c charge.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: charge.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c moment.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: moment.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfint0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfint0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mdet.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mdet.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gencfrc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gencfrc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c checkstop.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: checkstop.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genbs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genbs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfirsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfirsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradwf2.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradwf2.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c closefiles.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: closefiles.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writelinen.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writelinen.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtlm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtlm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtpack.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtpack.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtpack.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtpack.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevalfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevalfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevalfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevalfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfmtfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfmtfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putkmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putkmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getkmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getkmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putepsinv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putepsinv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getcfgq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getcfgq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevalsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevalsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevalsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevalsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevecsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevecsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevecsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevecsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genshtmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genshtmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genshtmat.f90:77:12: 77 | cbshti(:,:)=zbshti(:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genshtmat.f90:78:12: 78 | cfshti(:,:)=zfshti(:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genshtmat.f90:125:12: 125 | cbshto(:,:)=zbshto(:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genshtmat.f90:126:12: 126 | cfshto(:,:)=zfshto(:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c allatoms.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: allatoms.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevecfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevecfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevecfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevecfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writesym.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writesym.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putoccsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putoccsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getoccsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getoccsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c torque.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: torque.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findqpt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findqpt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findkpt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findkpt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genevfsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genevfsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sortidx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sortidx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c radnucl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: radnucl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrvf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrvf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeqpts.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeqpts.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rndevsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rndevsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengkvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengkvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mixlinear.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mixlinear.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writesf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writesf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengqf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengqf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genkmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genkmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genolpq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genolpq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjlgprmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjlgprmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfinterp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfinterp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fsmooth.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fsmooth.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c axangrot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: axangrot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rotaxang.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rotaxang.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wspline.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wspline.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c splined.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: splined.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findswidth.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findswidth.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findsymlat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findsymlat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writepmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writepmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genstrain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genstrain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symmetry.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symmetry.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c linengy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: linengy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writestress.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writestress.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eulerrot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eulerrot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zftwfir.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zftwfir.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rschrodint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rschrodint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegclq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegclq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegeom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegeom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writemom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writemom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c curlrvf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: curlrvf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzvclmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzvclmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjtot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjtot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c checkwrite.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: checkwrite.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjprk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjprk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c proj2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: proj2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genidxbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genidxbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrvfir.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrvfir.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjpr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjpr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnfvr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnfvr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentau.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentau.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjlgpr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjlgpr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writestrain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writestrain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writefermi.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writefermi.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtctof.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtctof.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findsym.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findsym.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhonorm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhonorm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvchi0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvchi0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtconj.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtconj.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta_sq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta_sq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta_lr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta_lr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta_lr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta_lr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findsymsite.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findsymsite.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genlmirep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genlmirep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writespecies.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writespecies.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomagk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomagk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrvfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrvfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wigner3jf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wigner3jf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genhvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genhvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ylmrot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ylmrot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wxcplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wxcplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c massnucl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: massnucl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c straingkq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: straingkq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oepmain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oepmain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdirac.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdirac.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bandstr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bandstr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sfacinit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sfacinit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findscq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findscq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plot1d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plot1d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plot2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plot2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plot3d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plot3d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readstate.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readstate.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnhf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnhf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined eveqnhf.f90:119:35: 52 | call genwfsv(.false.,.true.,nstsv,0,ngdgc,igfc,ngk(1,ikp),igkig(:,1,ikp), & | 2 ...... 119 | call genwfsv(.false.,.false.,nst,idx,ngdgc,igfc,ngk(1,ik),igkig(:,1,ik), & | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zbsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zbsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c i3mtv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: i3mtv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c spline.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: spline.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gauntyry.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gauntyry.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findnjcmax.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findnjcmax.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gndstate.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gndstate.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sstask.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sstask.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fermisurf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fermisurf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c spiralsc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: spiralsc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c atom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: atom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c maginit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: maginit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c exxengyk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: exxengyk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_c_tb09.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_c_tb09.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c moke.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: moke.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlrad.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlrad.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dos.f90: In function 'dos_': dos.f90:343:25: warning: 'elm.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 343 | lm,elm(lm,ias) | ^ dos.f90:60:50: note: 'elm.dim[1].stride' was declared here 60 | real(8), allocatable :: dt(:,:),dp(:,:,:),elm(:,:) | ^ dos.f90:343:25: warning: 'elm.offset' may be used uninitialized [-Wmaybe-uninitialized] 343 | lm,elm(lm,ias) | ^ dos.f90:60:50: note: 'elm.offset' was declared here 60 | real(8), allocatable :: dt(:,:),dp(:,:,:),elm(:,:) | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findprimcell.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findprimcell.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotpt2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotpt2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sfacrho.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sfacrho.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bdipole.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bdipole.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dielectric.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dielectric.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c elfplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: elfplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vclcore.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vclcore.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtwr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtwr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zvcldisp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zvcldisp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vecfbz.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vecfbz.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gcd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gcd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c lopzflmn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: lopzflmn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zpotclmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zpotclmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readfermi.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readfermi.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gensdmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gensdmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sphcrd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sphcrd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potcoul.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potcoul.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzrm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzrm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rminv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rminv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rtozfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rtozfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfsvp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfsvp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdiracint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdiracint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rotzflm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rotzflm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c latvstep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: latvstep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradzfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradzfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c cbsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: cbsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c cfsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: cfsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfmtsv_sp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfmtsv_sp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined wfmtsv_sp.f90:196:8: 196 | cf(1,:)=cf(1,:)+z*rf(1,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfirsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfirsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfsv_sp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfsv_sp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_4.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_4.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_4.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_4.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c trzhmm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: trzhmm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rvcopy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rvcopy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dolpistl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dolpistl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmlistl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmlistl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpaloq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpaloq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlaloq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlaloq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dolpalo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dolpalo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmlalo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmlalo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmllolo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmllolo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpaaq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpaaq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dolpaa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dolpaa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmlaa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmlaa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlaaq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlaaq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c initeph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: initeph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined initeph.f90:105:26: 105 | ephmkq(:,:,:,ik,iq)=ephmat(:,:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dengyeph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dengyeph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gndsteph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gndsteph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gndsteph.f90:46:42: 42 | call mixerifc(mixtype,nmix,duvwx,dv,nwork,duvwx) | 2 ...... 46 | call mixerifc(mixtype,nmix,duvwx,dv,nwork,work) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/COMPLEX(8)). mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqneph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqneph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlepha.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlepha.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlephb.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlephb.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlephde.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlephde.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getephmkq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getephmkq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ephdos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ephdos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradrhomt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradrhomt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendcfun.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendcfun.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendvsig.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendvsig.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c drhomagsh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: drhomagsh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c doccupy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: doccupy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmlrad.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmlrad.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendwfsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendwfsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gendwfsv.f90: In function 'gendwfsv_': gendwfsv.f90:32:58: warning: 'dwfmt1.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 32 | complex(8), allocatable :: wfmt1(:,:),wfmt2(:),dwfmt1(:,:) | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dwfmtfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dwfmtfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengqvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengqvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmatch.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmatch.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writedvs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writedvs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readdyn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readdyn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dyntask.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dyntask.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dpotks.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dpotks.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dpotxc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dpotxc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dpotxc.f90: In function 'dpotxc_': dpotxc.f90:16:44: warning: 'dbmt.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 16 | complex(8), allocatable :: dvmt(:),dbmt(:,:),zfmt(:) | ^ dpotxc.f90:16:44: warning: 'dbmt.offset' may be used uninitialized [-Wmaybe-uninitialized] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c deveqnfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: deveqnfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dpotcoul.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dpotcoul.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c drhomagk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: drhomagk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengvsmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengvsmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dforce.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dforce.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dforcek.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dforcek.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dforcek.f90: In function 'dforcek_': dforcek.f90:30:51: warning: 'devecsv.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 30 | complex(8), allocatable :: evecsv(:,:),devecsv(:,:) | ^ dforcek.f90:30:51: warning: 'devecsv.offset' may be used uninitialized [-Wmaybe-uninitialized] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynqtor.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynqtor.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynevs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynevs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phonon.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phonon.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined phonon.f90:119:41: 80 | call mixerifc(mtype,nmix,dvsbs,ddv,nwork,dvsbs) | 2 ...... 119 | call mixerifc(mtype,nmix,dvsbs,ddv,nwork,work) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/COMPLEX(8)). mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynrtoq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynrtoq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mcmillan.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mcmillan.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genephmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genephmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengkqvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengkqvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genmcph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genmcph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putdevecfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putdevecfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getdevecfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getdevecfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putdevecsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putdevecsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getdevecsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getdevecsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phononsc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phononsc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genscph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genscph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phdisp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phdisp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynsymapp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynsymapp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynsym.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynsym.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynev.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynev.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phdos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phdos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sumrule.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sumrule.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writephn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writephn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynfext.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynfext.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegamma.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegamma.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readgamma.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readgamma.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phlwidth.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phlwidth.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c alpha2f.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: alpha2f.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writelambda.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writelambda.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ephcouple.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ephcouple.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eliashberg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eliashberg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phscdvs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phscdvs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readdvs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readdvs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readalpha2f.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readalpha2f.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendsocfr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendsocfr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bornechg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bornechg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bectask.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bectask.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c becfext.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: becfext.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putephmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putephmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getephmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getephmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_pzca.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_pzca.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_pwca.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_pwca.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_pbe.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_pbe.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_am05.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_am05.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_xalpha.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_xalpha.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_wc06.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_wc06.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c x_wc06.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: x_wc06.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c x_pbe.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: x_pbe.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c c_pbe.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: c_pbe.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c c_pbe_gcor.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: c_pbe_gcor.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_vbh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_vbh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fxc_pwca.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fxc_pwca.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c k_tfvw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: k_tfvw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c k_tfvw_sp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: k_tfvw_sp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c k_tfvw1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: k_tfvw1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c k_vwlb.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: k_vwlb.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendmatmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendmatmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genveedu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genveedu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tm2todm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tm2todm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tm3todm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tm3todm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmtotm3.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmtotm3.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writedftu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writedftu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sbesseli.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sbesseli.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c shankeli.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: shankeli.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genfdu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genfdu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genfdufr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genfdufr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c engyfdu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: engyfdu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findlambda.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findlambda.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vmatmtsc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vmatmtsc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvmatmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvmatmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vmatmtdu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vmatmtdu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vmatmtftm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vmatmtftm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fyukawa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fyukawa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fyukawa0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fyukawa0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readdmatmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readdmatmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetm3.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetm3.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendmftm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendmftm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeftm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeftm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetm3td.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetm3td.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwkpr0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwkpr0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tm3rtoz.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tm3rtoz.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmft.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmft.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmwriteengy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmwriteengy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmminc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmminc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmvaryc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmvaryc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdedc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdedc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmengyxc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmengyxc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rdmengyxc.f90: In function 'rdmengyxc_': rdmengyxc.f90:73:45: warning: 't2' may be used uninitialized [-Wmaybe-uninitialized] 73 | engyx=engyx-t2*vclijji(ist2,ist1,ik2) | ^ rdmengyxc.f90:24:13: note: 't2' was declared here 24 | real(8) t1,t2,t3,t4 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmminn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmminn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmvaryn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmvaryn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdkdc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdkdc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmenergy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmenergy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmwritededn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmwritededn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdedn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdedn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdexcdn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdexcdn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rdmdexcdn.f90: In function 'rdmdexcdn_': rdmdexcdn.f90:77:63: warning: 't2' may be used uninitialized [-Wmaybe-uninitialized] 77 | dedn(ist2,ik2)=dedn(ist2,ik2)+t2*vclijji(ist2,ist1,ik2) | ^ rdmdexcdn.f90:31:13: note: 't2' was declared here 31 | real(8) t1,t2,t3,t4 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvclijjk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvclijjk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getvclijji.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getvclijji.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getvclijjk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getvclijjk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writevclijji.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writevclijji.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writevclijjk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writevclijjk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdexcdc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdexcdc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rdmdexcdc.f90: In function 'rdmdexcdc_': rdmdexcdc.f90:80:40: warning: 't2' may be used uninitialized [-Wmaybe-uninitialized] 80 | vclijjk(ist1,ist3,ist4,ik2) | ^ rdmdexcdc.f90:29:13: note: 't2' was declared here 29 | real(8) t1,t2,t3 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdtsdn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdtsdn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmentropy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmentropy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmeval.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmeval.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvclijji.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvclijji.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwdmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwdmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwlocal.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwlocal.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwgw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwgw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ksinvert.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ksinvert.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gtwsum.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gtwsum.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c minf_nm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: minf_nm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c acpole.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: acpole.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwrhomag.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwrhomag.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwdmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwdmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwefermi.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwefermi.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dysonr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dysonr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwsefm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwsefm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putgwsefm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putgwsefm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getgwsefm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getgwsefm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeigw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeigw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c polefit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: polefit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwchgk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwchgk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwsefmk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwsefmk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwspecf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwspecf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegwsf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegwsf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c acgwse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: acgwse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fmin_nm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fmin_nm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfpole.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfpole.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwbandstr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwbandstr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwscrho.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwscrho.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c atptstep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: atptstep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potkst.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potkst.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tdbackup.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tdbackup.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetimes.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetimes.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readtimes.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readtimes.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentimes.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentimes.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readafieldt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readafieldt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tddft.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tddft.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c timestep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: timestep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tddftlr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tddftlr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genhmlt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genhmlt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetddos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetddos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeafpdt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeafpdt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readafindt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readafindt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvfxc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvfxc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genfxcr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genfxcr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genfxcr.f90: In function 'genfxcr_': genfxcr.f90:18:57: warning: 'mag.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 18 | real(8), allocatable :: rho(:),rhoup(:),rhodn(:),mag(:,:) | ^ genfxcr.f90:18:57: warning: 'mag.offset' may be used uninitialized [-Wmaybe-uninitialized] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tdtemp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tdtemp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetdlsj.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetdlsj.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genspfxcr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genspfxcr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvfxcg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvfxcg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tddftsplr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tddftsplr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genspfxcg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genspfxcg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genafieldt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genafieldt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetddft.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetddft.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dielectric_tdrt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dielectric_tdrt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readjtot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readjtot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c afindtstep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: afindtstep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genefieldt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genefieldt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c energytd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: energytd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c engyknk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: engyknk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readforcet.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readforcet.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tdrestart.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tdrestart.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readdatposc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readdatposc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writedatposc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writedatposc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhostatic.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhostatic.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c jtotk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: jtotk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhosplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhosplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bornecdyn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bornecdyn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c becforce.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: becforce.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfirctof.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfirctof.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevalu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevalu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writekpa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writekpa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genhdbulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genhdbulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vblocalu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vblocalu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c chargeu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: chargeu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c addbfsmu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: addbfsmu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c momentu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: momentu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c occupyulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: occupyulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potksu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potksu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writevclr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writevclr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzvmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzvmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genzvmatk.f90:48:19: 48 | wfmt1(1:npc)=zvmt(1:npc,ias)*wfmt(1:npc,ias,ispn,jst) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzvbmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzvbmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genzvbmatk.f90:161:10: 161 | wf21(i)=(zv(i)+zb(i))*wf11(i) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genzvbmatk.f90:162:10: 162 | wf22(i)=(zv(i)-zb(i))*wf12(i) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genzvbmatk.f90:131:10: 131 | wf21(i)=(zv(i)+zb3(i))*wf11(i)+(zb1(i)-z1)*wf12(i) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genzvbmatk.f90:132:10: 132 | wf22(i)=(zv(i)-zb3(i))*wf12(i)+(zb1(i)+z1)*wf11(i) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomagq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomagq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeengyu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeengyu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfzfftq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfzfftq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhocoreu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhocoreu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomaguk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomaguk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genhmlu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genhmlu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potxcu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potxcu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeinfou.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeinfou.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vclqinit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vclqinit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writechgrmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writechgrmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c initulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: initulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writemomrmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writemomrmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writestulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writestulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readstulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readstulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potefieldu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potefieldu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c puthdbulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: puthdbulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gethdbulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gethdbulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potuinit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potuinit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readvclr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readvclr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genkpakq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genkpakq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotu1d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotu1d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotu2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotu2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotu3d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotu3d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gndstulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gndstulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gndstulr.f90:79:42: 75 | call mixerifc(mixtype,nmix,vsbsq,dv,nwork,vsbsq) | 2 ...... 79 | call mixerifc(mixtype,nmix,vsbsq,dv,nwork,work) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/COMPLEX(8)). mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potuplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potuplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potcoulu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potcoulu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhouplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhouplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c maguplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: maguplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c initw90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: initw90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90win.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90win.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90eig.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90eig.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c setupw90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: setupw90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90mmn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90mmn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90spn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90spn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmatuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmatuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dmatuv.f90:21:8: 21 | vn(i)=dot_product(v(:,i),v(:,i)) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to REAL(8) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmatwx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmatwx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dmatwx.f90:19:8: 19 | xn(i)=dot_product(x(:,i),x(:,i)) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to REAL(8) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnwxy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnwxy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevaluv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevaluv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c occupyuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: occupyuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevaluv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevaluv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevaluv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevaluv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevecuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevecuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevecuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevecuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevecwxy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevecwxy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevecwxy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevecwxy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevalwx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevalwx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevalwx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevalwx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c aceplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: aceplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevalwx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevalwx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -o elk modmain.o modmpi.o modramdisk.o libxcf90.o libxcifc.o modxcifc.o modfxcifc.o moddftu.o modrdm.o modphonon.o modtest.o modrandom.o modstore.o modpw.o modvars.o modtddft.o modgw.o modulr.o modbog.o moddelf.o modomp.o mkl_stub.o mkl_init.o oblas_init.o blis_stub.o blis_init.o w90_stub.o modw90.o zfftifc_fftw.o elk.o r3mm.o r3mtm.o r3mmt.o r3vo.o gengvec.o wigner3j.o gengvc.o potnucl.o zfmtint.o rfmtint.o genvsig.o rfmtinp.o findngkmax.o potks.o mtdmin.o rfcopy.o rhomagv.o eveqn.o genffacgp.o unitary.o zmdet.o rfmtftoc.o zminv.o symrf.o genvmat.o writeeval.o mixerifc.o splinew.o nfftifc.o symdmat.o z2mm.o z2mctm.o z2mmct.o axangsu2.o gradzvcln.o gentpmae.o zfcmtwr.o projsbf.o gradzf.o timesec.o zfmtftoc.o ztorfmt.o zfmtctof.o eveqnfvz.o energynn.o gaunt.o potxcmt.o sdelta_mp.o stheta_mp.o sdelta_fd.o stheta_fd.o writelsj.o eveqnzh.o gensmatk.o gensfacgp.o rhomag.o wsplintp.o checkmt.o reciplat.o gradrf.o genzfrm.o mixadapt.o zftrf.o sbessel.o gengclgq.o gencfun.o factr.o genstress.o force.o genvbmatk.o forcek.o writeepsinv.o olprad.o polark.o zfmtinp.o hflocal.o mixbroyden.o grad2rfmt.o clebgor.o rfirctof.o effmass.o zpotcoul.o sfacmag.o polynm.o epsinv.o rfinpc.o zmctmu.o zmctm.o writeiad.o genapwfr.o gengclq.o addbfsm.o genylmv.o olpfv.o hmlfv.o genexpmt.o rfinp.o factnm.o sphcover.o sctovec.o genppts.o eveqnzg.o fderiv.o genpmat.o genexpmat.o writeforces.o r3cross.o match.o genspchi0.o genzrho.o potefield.o rhoinit.o eveqnsv.o roteuler.o genrmesh.o splint.o wavefcr.o lopzflm.o brzint.o rotdmat.o genylmg.o gentaucr.o readinput.o numlist.o hermite.o genfspecies.o atpstep.o dmatls.o writeengy.o writechg.o rbsht.o rfsht.o genlofr.o rotrfmt.o zftzf.o genpmatk.o rvfcross.o writeinfo.o mossbauer.o initoep.o i3minv.o r3mv.o genidxlo.o nuclei.o writeefg.o writeevsp.o gencore.o r3mtv.o r3minv.o r3frac.o genapwlofr.o gridsize.o symrfir.o geomplot.o ylmroty.o gengvclns.o ssfext.o writestate.o sdelta_sq.o potxcir.o potxc.o rzfmtinp.o rhoplot.o occupy.o symveca.o jprplot.o genvmatk.o geomopt.o eveqnss.o hartfock.o potplot.o genwfpw.o hmlxbse.o hmlxbsek.o hmldbse.o hmldbsek.o gradwfcr2.o oepresk.o addlorbcnd.o energy.o wfplot.o oepvcl.o oepvclk.o polar.o dbxcplot.o sbesseldm.o writehmlbse.o dielectric_bse.o vecplot.o nesting.o writeevbse.o emdplot3d.o emdplot2d.o emdplot1d.o rfhkintp.o writewfpw.o vblocal.o writefsm.o getwfpw.o plotpt1d.o init1.o init2.o findsymcrys.o plotpt3d.o elnes.o fermisurfbxsf.o genspecies.o writeexpmat.o writekpts.o wfcrplot.o writedos.o energykncr.o ggamt_1.o ggair_1.o ggamt_sp_1.o ggair_sp_1.o ggamt_2a.o ggair_2a.o ggamt_2b.o ggair_2b.o ggamt_sp_2a.o ggair_sp_2a.o ggamt_sp_2b.o ggair_sp_2b.o writeemd.o reademd.o emdplot.o init3.o init4.o bfieldfsm.o testcheck.o pade.o wsplint.o gensocfr.o pades.o genscss.o rfcmtwr.o nonlinopt.o writelat.o rhocore.o rzfinp.o readspecies.o findband.o exxengy.o gentauk.o gradrfmt.o checkfsm.o genrlmv.o mae.o writegvecrf.o zcfmtwr.o wfmtsv.o olpistl.o hmlistl.o olpalo.o hmlalo.o olplolo.o hmllolo.o olpaa.o hmlaa.o gengclg.o rhomagsh.o charge.o moment.o rfint0.o r3mdet.o gencfrc.o checkstop.o genbs.o rfirsm.o rfmtsm.o rfint.o gradwf2.o closefiles.o writelinen.o rfmtlm.o putpmat.o getpmat.o rfmtpack.o zfmtpack.o putevalfv.o getevalfv.o wfmtfv.o putkmat.o getkmat.o putepsinv.o getcfgq.o putevalsv.o getevalsv.o getevecsv.o putevecsv.o genshtmat.o allatoms.o putevecfv.o getevecfv.o writesym.o putoccsv.o getoccsv.o torque.o findqpt.o findkpt.o genevfsv.o genwfsv.o sdelta.o stheta.o sortidx.o symmat.o radnucl.o symrvf.o writeqpts.o rndevsv.o gengkvec.o mixlinear.o writesf.o gengqf.o genkmat.o genolpq.o genjlgprmt.o rfinterp.o fsmooth.o axangrot.o rotaxang.o wspline.o splined.o findswidth.o findsymlat.o writepmat.o genstrain.o symmetry.o linengy.o writestress.o eulerrot.o zftwfir.o rschrodint.o writegclq.o writegeom.o writemom.o gendmat.o curlrvf.o genzvclmt.o genjtot.o symvec.o checkwrite.o genjprk.o proj2d.o genidxbse.o symrvfir.o genjpr.o eveqnfvr.o gentau.o genjlgpr.o writestrain.o writefermi.o rfmtctof.o findsym.o zfsht.o rhonorm.o genvchi0.o zfmtconj.o stheta_sq.o sdelta_lr.o stheta_lr.o findsymsite.o genlmirep.o writespecies.o rhomagk.o symrvfmt.o wigner3jf.o genhvec.o ylmrot.o wxcplot.o massnucl.o gendmatk.o rfplot.o straingkq.o eveqnit.o oepmain.o rdirac.o bandstr.o sfacinit.o findscq.o plot1d.o plot2d.o plot3d.o init0.o readstate.o eveqnhf.o zbsht.o i3mtv.o spline.o gauntyry.o findnjcmax.o gndstate.o sstask.o fermisurf.o spiralsc.o atom.o maginit.o exxengyk.o xc_c_tb09.o moke.o hmlrad.o dos.o findprimcell.o plotpt2d.o sfacrho.o bdipole.o dielectric.o elfplot.o vclcore.o zfmtwr.o zvcldisp.o vecfbz.o gcd.o lopzflmn.o zpotclmt.o readfermi.o gensdmat.o symrfmt.o sphcrd.o potcoul.o genzrm.o rminv.o rtozfmt.o genwfsvp.o rdiracint.o rotzflm.o zfinp.o latvstep.o gradzfmt.o eveqnfv.o cbsht.o cfsht.o wfmtsv_sp.o wfirsv.o genwfsv_sp.o ggamt_4.o ggair_4.o trzhmm.o rvcopy.o dolpistl.o dhmlistl.o olpaloq.o hmlaloq.o dolpalo.o dhmlalo.o dhmllolo.o olpaaq.o dolpaa.o dhmlaa.o hmlaaq.o initeph.o dengyeph.o gndsteph.o eveqneph.o hmlepha.o hmlephb.o hmlephde.o getephmkq.o ephdos.o gradrhomt.o gendcfun.o gendvsig.o drhomagsh.o doccupy.o dhmlrad.o gendwfsv.o dwfmtfv.o gengqvec.o dmatch.o writedvs.o readdyn.o dyntask.o dpotks.o dpotxc.o deveqnfv.o dpotcoul.o drhomagk.o gengvsmt.o dforce.o dforcek.o dynqtor.o dynevs.o phonon.o dynrtoq.o mcmillan.o genephmat.o gengkqvec.o genmcph.o putdevecfv.o getdevecfv.o putdevecsv.o getdevecsv.o phononsc.o genscph.o phdisp.o dynsymapp.o dynsym.o dynev.o phdos.o sumrule.o writephn.o dynfext.o writegamma.o readgamma.o phlwidth.o alpha2f.o writelambda.o ephcouple.o eliashberg.o phscdvs.o readdvs.o readalpha2f.o gendsocfr.o bornechg.o bectask.o becfext.o putephmat.o getephmat.o xc_pzca.o xc_pwca.o xc_pbe.o xc_am05.o xc_xalpha.o xc_wc06.o x_wc06.o x_pbe.o c_pbe.o c_pbe_gcor.o xc_vbh.o fxc_pwca.o k_tfvw.o k_tfvw_sp.o k_tfvw1.o k_vwlb.o gendmatmt.o genveedu.o tm2todm.o tm3todm.o dmtotm3.o writedftu.o sbesseli.o shankeli.o genfdu.o genfdufr.o engyfdu.o findlambda.o vmatmtsc.o genvmatmt.o vmatmtdu.o vmatmtftm.o fyukawa.o fyukawa0.o readdmatmt.o writetm.o writetm3.o gendmftm.o writeftm.o writetm3td.o genwkpr0.o tm3rtoz.o rdmft.o rdmwriteengy.o rdmminc.o rdmvaryc.o rdmdedc.o rdmengyxc.o rdmminn.o rdmvaryn.o rdmdkdc.o rdmenergy.o rdmwritededn.o rdmdedn.o rdmdexcdn.o genvclijjk.o getvclijji.o getvclijjk.o writevclijji.o writevclijjk.o rdmdexcdc.o rdmdtsdn.o rdmentropy.o rdmeval.o genvclijji.o gwdmat.o gwlocal.o genwgw.o ksinvert.o gtwsum.o minf_nm.o acpole.o gwrhomag.o gwdmatk.o gwefermi.o dysonr.o gwsefm.o putgwsefm.o getgwsefm.o writeigw.o polefit.o gwchgk.o gwsefmk.o gwspecf.o writegwsf.o acgwse.o fmin_nm.o zfpole.o gwbandstr.o gwscrho.o atptstep.o potkst.o tdbackup.o writetimes.o readtimes.o gentimes.o readafieldt.o genjr.o tddft.o timestep.o tddftlr.o genhmlt.o writetddos.o writeafpdt.o readafindt.o genvfxc.o genfxcr.o tdtemp.o writetdlsj.o genspfxcr.o genvfxcg.o tddftsplr.o genspfxcg.o genafieldt.o writetddft.o dielectric_tdrt.o readjtot.o afindtstep.o genefieldt.o energytd.o engyknk.o readforcet.o tdrestart.o readdatposc.o writedatposc.o rhostatic.o jtotk.o rhosplot.o bornecdyn.o becforce.o zfirctof.o writeevalu.o writekpa.o genhdbulr.o vblocalu.o chargeu.o addbfsmu.o momentu.o occupyulr.o potksu.o writevclr.o genzvmatk.o genzvbmatk.o rhomagq.o writeengyu.o rfzfftq.o rhocoreu.o eveqnulr.o rhomaguk.o genhmlu.o potxcu.o writeinfou.o zfplot.o vclqinit.o writechgrmt.o initulr.o writemomrmt.o writestulr.o readstulr.o potefieldu.o puthdbulr.o gethdbulr.o potuinit.o readvclr.o genkpakq.o plotu1d.o plotu2d.o plotu3d.o gndstulr.o plotulr.o potuplot.o potcoulu.o rhouplot.o maguplot.o initw90.o writew90.o writew90win.o writew90eig.o setupw90.o writew90mmn.o writew90spn.o dmatuv.o dmatwx.o eveqnuv.o eveqnwxy.o writeevaluv.o occupyuv.o genwfuv.o putevaluv.o getevaluv.o putevecuv.o getevecuv.o putevecwxy.o getevecwxy.o putevalwx.o getevalwx.o aceplot.o writeevalwx.o -L/usr/lib64 -lflexiblas -L/usr/lib64 -lfftw3 \ -L/usr/lib64 -lxc -lxcf90 fmin_nm.f90:15:23: warning: type of 'polefit' does not match original declaration [-Wlto-type-mismatch] 15 | fmin_nm=polefit(rd,x) | ^ polefit.f90:6:24: note: 'polefit' was previously declared here 6 | real(8) function polefit(zfm,c) | ^ polefit.f90:6:24: note: code may be misoptimized unless '-fno-strict-aliasing' is used acpole.f90:64:31: warning: type of 'zfpole' does not match original declaration [-Wlto-type-mismatch] 64 | zr(iw)=zfpole(x(:,1),zwr(iw)) | ^ zfpole.f90:6:31: note: 'zfpole' was previously declared here 6 | pure complex(8) function zfpole(c,z) | ^ zfpole.f90:6:31: note: code may be misoptimized unless '-fno-strict-aliasing' is used acpole.f90:30:38: warning: type of 'minf_nm' does not match original declaration [-Wlto-type-mismatch] 30 | call minf_nm(1,zm,n2,x,maxit,iter,eps) | ^ minf_nm.f90:6:18: note: 'minf_nm' was previously declared here 6 | subroutine minf_nm(id,rd,n,x,maxit,iter,eps) | ^ minf_nm.f90:6:18: note: code may be misoptimized unless '-fno-strict-aliasing' is used findsymsite.f90:29:75: warning: type of 'findsym' does not match original declaration [-Wlto-type-mismatch] 29 | call findsym(apl,apl,nsymsite(ias),lsplsyms(:,ias),lspnsyms(:,ias),iea) | ^ findsym.f90:9:18: note: 'findsym' was previously declared here 9 | subroutine findsym(apl1,apl2,nsym,lspl,lspn,iea) | ^ findsym.f90:9:18: note: code may be misoptimized unless '-fno-strict-aliasing' is used chargeu.f90:36:34: warning: type of 'ddot' does not match original declaration [-Wlto-type-mismatch] 36 | t1=ddot(ngtc,rhoqir(:,1),2,cfrc,1) | ^ zmctmu.f90:29:46: note: 'ddot' was previously declared here 29 | c(i,j)=c(i,j)+ddot(l2,a(:,i),1,b(:,j),1) | ^ zmctmu.f90:29:46: note: code may be misoptimized unless '-fno-strict-aliasing' is used gndsteph.f90:42:48: warning: type of 'mixerifc' does not match original declaration [-Wlto-type-mismatch] 42 | call mixerifc(mixtype,nmix,duvwx,dv,nwork,duvwx) | ^ mixerifc.f90:6:19: note: 'mixerifc' was previously declared here 6 | subroutine mixerifc(mtype,n,v,dv,nwork,work) | ^ mixerifc.f90:6:19: note: code may be misoptimized unless '-fno-strict-aliasing' is used modramdisk.f90:264:47: warning: type of 'rvcopy' does not match original declaration [-Wlto-type-mismatch] 264 | call rvcopy(3,file(fnum)%rec(irec)%dat(i),v1) | ^ modramdisk.f90:189:47: warning: type of 'rvcopy' does not match original declaration [-Wlto-type-mismatch] 189 | call rvcopy(3,v1,file(fnum)%rec(irec)%dat(i)) | ^ rvcopy.f90:6:22: note: 'rvcopy' was previously declared here 6 | pure subroutine rvcopy(n,x,y) | ^ rvcopy.f90:6:22: note: code may be misoptimized unless '-fno-strict-aliasing' is used make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' cd src/eos; make make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src/eos' mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modmain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modmain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c pveos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: pveos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readinput.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readinput.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getedata.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getedata.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fitdata.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fitdata.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c output.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: output.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c minf_nm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: minf_nm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fmin_nm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fmin_nm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -o eos modmain.o eos.o eveos.o pveos.o readinput.o getedata.o fitdata.o output.o minf_nm.o fmin_nm.o make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src/eos' cd src/spacegroup; make make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src/spacegroup' mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modmain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modmain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c main.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: main.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readinput.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readinput.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gencrystal.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gencrystal.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sgsymb.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sgsymb.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c seitzgen.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: seitzgen.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengroup.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengroup.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c seitzeq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: seitzeq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c seitzmul.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: seitzmul.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegeom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegeom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c geomplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: geomplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findprimcell.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findprimcell.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3frac.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3frac.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3cross.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3cross.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3minv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3minv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/openmpi -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -o spacegroup modmain.o main.o readinput.o gencrystal.o sgsymb.o seitzgen.o gengroup.o seitzeq.o seitzmul.o writegeom.o geomplot.o findprimcell.o r3frac.o r3mv.o r3cross.o r3minv.o r3mm.o make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src/spacegroup' + mv src/elk elk_openmpi + /usr/bin/make clean cd src; make cleanall make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' cd BLAS; make clean /bin/sh: line 1: cd: BLAS: No such file or directory make[2]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' rm -f *.o *.mod *~ ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf *.tex *.toc *.out elk make[2]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' cd LAPACK; make clean /bin/sh: line 1: cd: LAPACK: No such file or directory make[2]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' rm -f *.o *.mod *~ ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf *.tex *.toc *.out elk make[2]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' cd fftlib; make clean /bin/sh: line 1: cd: fftlib: No such file or directory make[2]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' rm -f *.o *.mod *~ ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf *.tex *.toc *.out elk make[2]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' make clean make[2]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' rm -f *.o *.mod *~ ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf *.tex *.toc *.out elk make[2]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' cd src/eos; make clean make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src/eos' rm -f *.o *.mod *~ fort.* ifc* *.gcno *.OUT gmon.out eos make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src/eos' cd src/spacegroup; make clean make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src/spacegroup' rm -f *.o *.mod *~ fort.* ifc* *.gcno *.OUT *.xsf *.ascii gmon.out \ *.aux *.dvi *.log *.pdf *.tex *.toc *.out spacegroup make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src/spacegroup' rm -f *.o *.mod *~ fort.* ifc* *.gcno *.exe + . /etc/profile.d/modules.sh ++ . /etc/profile.d/00-modulepath.sh +++ '[' -z /etc/modulefiles:/usr/share/modulefiles:/usr/share/modulefiles/Linux:/usr/share/modulefiles/Core:/usr/share/lmod/lmod/modulefiles/Core ']' +++ : ++ '[' -z '' ']' ++ LMOD_ALLOW_ROOT_USE=yes ++ '[' -n '' ']' ++ '[' yes '!=' yes ']' ++ '[' -z /usr/share/modulefiles ']' ++ findExec READLINK_CMD /usr/bin/readlink readlink ++ Nm=READLINK_CMD ++ confPath=/usr/bin/readlink ++ execNm=readlink ++ eval READLINK_CMD=/usr/bin/readlink +++ READLINK_CMD=/usr/bin/readlink ++ '[' '!' -x /usr/bin/readlink ']' ++ unset Nm confPath execNm ++ findExec PS_CMD /usr/bin/ps ps ++ Nm=PS_CMD ++ confPath=/usr/bin/ps ++ execNm=ps ++ eval PS_CMD=/usr/bin/ps +++ PS_CMD=/usr/bin/ps ++ '[' '!' -x /usr/bin/ps ']' ++ unset Nm confPath execNm ++ findExec EXPR_CMD /usr/bin/expr expr ++ Nm=EXPR_CMD ++ confPath=/usr/bin/expr ++ execNm=expr ++ eval EXPR_CMD=/usr/bin/expr +++ EXPR_CMD=/usr/bin/expr ++ '[' '!' -x /usr/bin/expr ']' ++ unset Nm confPath execNm ++ findExec BASENAME_CMD /usr/bin/basename basename ++ Nm=BASENAME_CMD ++ confPath=/usr/bin/basename ++ execNm=basename ++ eval BASENAME_CMD=/usr/bin/basename +++ BASENAME_CMD=/usr/bin/basename ++ '[' '!' -x /usr/bin/basename ']' ++ unset Nm confPath execNm ++ unset -f findExec ++ '[' -f /proc/50/exe ']' +++ /usr/bin/readlink /proc/50/exe ++ my_shell=/usr/bin/bash +++ /usr/bin/expr /usr/bin/bash : '-*\(.*\)' ++ my_shell=/usr/bin/bash +++ /usr/bin/basename /usr/bin/bash ++ my_shell=bash ++ case ${my_shell} in ++ '[' -f /usr/share/lmod/lmod/init/bash ']' ++ . /usr/share/lmod/lmod/init/bash +++ '[' -z '' ']' +++ case "$-" in +++ __lmod_vx=x +++ '[' -n x ']' +++ set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for this output (/usr/share/lmod/lmod/init/bash) Shell debugging restarted +++ unset __lmod_vx ++ unset my_shell PS_CMD EXPR_CMD BASENAME_CMD MODULEPATH_INIT LMOD_ALLOW_ROOT_USE READLINK_CMD + module unload mpi/openmpi-ppc64le + local __lmod_my_status + local __lmod_sh_dbg + '[' -z '' ']' + case "$-" in + __lmod_sh_dbg=x + '[' -n x ']' + set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for Lmod's output Shell debugging restarted + return 0 + rm -rf src + cp -rp src.orig src + . /etc/profile.d/modules.sh ++ . /etc/profile.d/00-modulepath.sh +++ '[' -z /etc/modulefiles:/usr/share/modulefiles:/usr/share/modulefiles/Linux:/usr/share/modulefiles/Core:/usr/share/lmod/lmod/modulefiles/Core ']' +++ : ++ '[' -z '' ']' ++ LMOD_ALLOW_ROOT_USE=yes ++ '[' -n '' ']' ++ '[' yes '!=' yes ']' ++ '[' -z /usr/share/modulefiles ']' ++ findExec READLINK_CMD /usr/bin/readlink readlink ++ Nm=READLINK_CMD ++ confPath=/usr/bin/readlink ++ execNm=readlink ++ eval READLINK_CMD=/usr/bin/readlink +++ READLINK_CMD=/usr/bin/readlink ++ '[' '!' -x /usr/bin/readlink ']' ++ unset Nm confPath execNm ++ findExec PS_CMD /usr/bin/ps ps ++ Nm=PS_CMD ++ confPath=/usr/bin/ps ++ execNm=ps ++ eval PS_CMD=/usr/bin/ps +++ PS_CMD=/usr/bin/ps ++ '[' '!' -x /usr/bin/ps ']' ++ unset Nm confPath execNm ++ findExec EXPR_CMD /usr/bin/expr expr ++ Nm=EXPR_CMD ++ confPath=/usr/bin/expr ++ execNm=expr ++ eval EXPR_CMD=/usr/bin/expr +++ EXPR_CMD=/usr/bin/expr ++ '[' '!' -x /usr/bin/expr ']' ++ unset Nm confPath execNm ++ findExec BASENAME_CMD /usr/bin/basename basename ++ Nm=BASENAME_CMD ++ confPath=/usr/bin/basename ++ execNm=basename ++ eval BASENAME_CMD=/usr/bin/basename +++ BASENAME_CMD=/usr/bin/basename ++ '[' '!' -x /usr/bin/basename ']' ++ unset Nm confPath execNm ++ unset -f findExec ++ '[' -f /proc/50/exe ']' +++ /usr/bin/readlink /proc/50/exe ++ my_shell=/usr/bin/bash +++ /usr/bin/expr /usr/bin/bash : '-*\(.*\)' ++ my_shell=/usr/bin/bash +++ /usr/bin/basename /usr/bin/bash ++ my_shell=bash ++ case ${my_shell} in ++ '[' -f /usr/share/lmod/lmod/init/bash ']' ++ . /usr/share/lmod/lmod/init/bash +++ '[' -z '' ']' +++ case "$-" in +++ __lmod_vx=x +++ '[' -n x ']' +++ set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for this output (/usr/share/lmod/lmod/init/bash) Shell debugging restarted +++ unset __lmod_vx ++ unset my_shell PS_CMD EXPR_CMD BASENAME_CMD MODULEPATH_INIT LMOD_ALLOW_ROOT_USE READLINK_CMD + module load mpi/mpich-ppc64le + local __lmod_my_status + local __lmod_sh_dbg + '[' -z '' ']' + case "$-" in + __lmod_sh_dbg=x + '[' -n x ']' + set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for Lmod's output Shell debugging restarted + return 0 + export 'CFLAGS=-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + CFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + cp -p make.inc.common make.inc + /usr/bin/sed -i 's|F90 =.*|F90 = mpif90 -fopenmp -fallow-argument-mismatch|' make.inc + /usr/bin/sed -i 's|F77 =.*|F77 = mpif77 -fopenmp -fallow-argument-mismatch|' make.inc + /usr/bin/sed -i 's|F90_OPTS =|F90_OPTS = -I/usr/lib64/gfortran/modules/mpich|' make.inc + echo 'SRC_MPI =' + cat make.inc SRC_MPI = mpi_stub.f90 F90 = mpif90 -fopenmp -fallow-argument-mismatch F77 = mpif77 -fopenmp -fallow-argument-mismatch F90_OPTS = -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection F77_OPTS = $(F90_OPTS) AR = ar SRC_MKL = mkl_stub.f90 SRC_BLIS = blis_stub.f90 SRC_W90S = w90_stub.f90 LIB_LPK = -L/usr/lib64 -lflexiblas LIB_FFT = -L/usr/lib64 -lfftw3 SRC_FFT = zfftifc_fftw.f90 LIB_libxc = -L/usr/lib64 -lxc -lxcf90 SRC_libxc = libxcf90.f90 libxcifc.f90 SRC_MPI = + cp -p make.inc make.inc_mpich + /usr/bin/make cd src; make all make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modmain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modmain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modmpi.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modmpi.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modramdisk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modramdisk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined modramdisk.f90:282:48: 264 | call rvcopy(3,file(fnum)%rec(irec)%dat(i),v1) | 2 ...... 282 | call rvcopy(2*nzv,file(fnum)%rec(irec)%dat(i),zva) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/REAL(8)). modramdisk.f90:189:16: 189 | call rvcopy(3,v1,file(fnum)%rec(irec)%dat(i)) | 1 ...... 264 | call rvcopy(3,file(fnum)%rec(irec)%dat(i),v1) | 2 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/INTEGER(4)). mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c libxcf90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: libxcf90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined libxcf90.f90:2212:26: 2212 | subroutine c_to_f_string(c_string, f_string) | ^ Warning: 'c_to_f_string' defined but not used [-Wunused-function] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c libxcifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: libxcifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modxcifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modxcifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modfxcifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modfxcifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c moddftu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: moddftu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modrdm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modrdm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modphonon.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modphonon.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modtest.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modtest.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modrandom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modrandom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modstore.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modstore.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modpw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modpw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modvars.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modvars.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modtddft.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modtddft.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modgw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modgw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modbog.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modbog.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c moddelf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: moddelf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modomp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modomp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mkl_stub.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mkl_stub.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mkl_stub.f90:8:42: 8 | subroutine mkl_set_num_threads(num_threads) | 1 Warning: Unused dummy argument 'num_threads' at (1) [-Wunused-dummy-argument] mkl_stub.f90:13:54: 13 | integer function mkl_set_num_threads_local(num_threads) | 1 Warning: Unused dummy argument 'num_threads' at (1) [-Wunused-dummy-argument] mkl_stub.f90:19:34: 19 | subroutine mkl_set_dynamic(dynamic) | 1 Warning: Unused dummy argument 'dynamic' at (1) [-Wunused-dummy-argument] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mkl_init.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mkl_init.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oblas_init.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oblas_init.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c blis_stub.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: blis_stub.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined blis_stub.f90:8:49: 8 | subroutine bli_thread_set_num_threads(num_threads) | 1 Warning: Unused dummy argument 'num_threads' at (1) [-Wunused-dummy-argument] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c blis_init.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: blis_init.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c w90_stub.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: w90_stub.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined w90_stub.f90:10:31: 10 | num_atoms_loc,atom_symbols_loc,atoms_cart_loc, gamma_only_loc,spinors_loc, & | 1 Warning: Unused dummy argument 'atom_symbols_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:10:46: 10 | num_atoms_loc,atom_symbols_loc,atoms_cart_loc, gamma_only_loc,spinors_loc, & | 1 Warning: Unused dummy argument 'atoms_cart_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:43: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'exclude_bands_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:10:62: 10 | num_atoms_loc,atom_symbols_loc,atoms_cart_loc, gamma_only_loc,spinors_loc, & | 1 Warning: Unused dummy argument 'gamma_only_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:9:48: 9 | real_lattice_loc,recip_lattice_loc,kpt_latt_loc,num_bands_tot, & | 1 Warning: Unused dummy argument 'kpt_latt_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:8:47: 8 | subroutine wannier_setup(seed__name,mp_grid_loc,num_kpts_loc, & | 1 Warning: Unused dummy argument 'mp_grid_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:32: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'nncell_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:21: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'nnlist_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:10: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'nntot_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:46: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'num_bands_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:11:59: 11 | nntot_loc,nnlist_loc,nncell_loc,num_bands_loc,num_wann_loc, & | 1 Warning: Unused dummy argument 'num_wann_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:25: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_l_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:36: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_m_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:52: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_radial_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:54: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'proj_s_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:71: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'proj_s_qaxis_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:14: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_site_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:11: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'proj_x_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:12:63: 12 | proj_site_loc,proj_l_loc,proj_m_loc,proj_radial_loc,proj_z_loc, & | 1 Warning: Unused dummy argument 'proj_z_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:13:25: 13 | proj_x_loc,proj_zona_loc,exclude_bands_loc,proj_s_loc,proj_s_qaxis_loc) | 1 Warning: Unused dummy argument 'proj_zona_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:9:17: 9 | real_lattice_loc,recip_lattice_loc,kpt_latt_loc,num_bands_tot, & | 1 Warning: Unused dummy argument 'real_lattice_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:9:35: 9 | real_lattice_loc,recip_lattice_loc,kpt_latt_loc,num_bands_tot, & | 1 Warning: Unused dummy argument 'recip_lattice_loc' at (1) [-Wunused-dummy-argument] w90_stub.f90:8:35: 8 | subroutine wannier_setup(seed__name,mp_grid_loc,num_kpts_loc, & | 1 Warning: Unused dummy argument 'seed__name' at (1) [-Wunused-dummy-argument] w90_stub.f90:10:74: 10 | num_atoms_loc,atom_symbols_loc,atoms_cart_loc, gamma_only_loc,spinors_loc, & | 1 Warning: Unused dummy argument 'spinors_loc' at (1) [-Wunused-dummy-argument] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modw90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modw90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfftifc_fftw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfftifc_fftw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c elk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: elk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mtm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mtm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3vo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3vo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wigner3j.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wigner3j.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengvc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengvc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potnucl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potnucl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvsig.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvsig.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findngkmax.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findngkmax.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potks.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potks.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mtdmin.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mtdmin.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mtdmin.f90: In function 'mtdmin_': mtdmin.f90:67:17: warning: 'rm' may be used uninitialized [-Wmaybe-uninitialized] 67 | dmin=sqrt(d2m)-rm | ^ mtdmin.f90:30:22: note: 'rm' was declared here 30 | real(8) d2,d2m,r,r2,rm,dr,drm | ^ mtdmin.f90:67:17: warning: 'd2m' may be used uninitialized [-Wmaybe-uninitialized] 67 | dmin=sqrt(d2m)-rm | ^ mtdmin.f90:30:14: note: 'd2m' was declared here 30 | real(8) d2,d2m,r,r2,rm,dr,drm | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfcopy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfcopy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomagv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomagv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genffacgp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genffacgp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c unitary.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: unitary.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zmdet.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zmdet.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtftoc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtftoc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zminv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zminv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeeval.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeeval.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mixerifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mixerifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c splinew.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: splinew.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c nfftifc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: nfftifc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symdmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symdmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c z2mm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: z2mm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c z2mctm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: z2mctm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c z2mmct.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: z2mmct.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c axangsu2.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: axangsu2.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradzvcln.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradzvcln.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentpmae.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentpmae.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfcmtwr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfcmtwr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c projsbf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: projsbf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradzf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradzf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c timesec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: timesec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtftoc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtftoc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ztorfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ztorfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtctof.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtctof.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnfvz.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnfvz.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c energynn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: energynn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gaunt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gaunt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potxcmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potxcmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined potxcmt.f90: In function 'potxcmt_': potxcmt.f90:33:41: warning: 'bxc.offset' may be used uninitialized [-Wmaybe-uninitialized] 33 | real(8), allocatable :: mag(:,:),bxc(:,:),tau(:,:) | ^ potxcmt.f90:33:41: warning: 'bxc.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] potxcmt.f90:41:45: warning: 'wcdn.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 41 | real(8), allocatable :: wc(:),wcup(:),wcdn(:) | ^ potxcmt.f90:41:29: warning: 'wc.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 41 | real(8), allocatable :: wc(:),wcup(:),wcdn(:) | ^ potxcmt.f90:31:45: warning: 'vxdn.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 31 | real(8), allocatable :: vx(:),vxup(:),vxdn(:) | ^ potxcmt.f90:293:22: warning: 'vc.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 293 | vxc(:)=vx(:)+vc(:) | ^ potxcmt.f90:32:29: note: 'vc.dim[0].ubound' was declared here 32 | real(8), allocatable :: vc(:),vcup(:),vcdn(:) | ^ potxcmt.f90:33:50: warning: 'tau.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 33 | real(8), allocatable :: mag(:,:),bxc(:,:),tau(:,:) | ^ potxcmt.f90:33:50: warning: 'tau.offset' may be used uninitialized [-Wmaybe-uninitialized] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta_mp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta_mp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta_mp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta_mp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta_fd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta_fd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta_fd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta_fd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writelsj.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writelsj.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnzh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnzh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gensmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gensmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gensfacgp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gensfacgp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomag.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomag.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wsplintp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wsplintp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c checkmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: checkmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c reciplat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: reciplat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradrf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradrf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzfrm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzfrm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mixadapt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mixadapt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zftrf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zftrf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sbessel.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sbessel.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengclgq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengclgq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gencfun.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gencfun.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c factr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: factr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genstress.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genstress.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c force.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: force.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined force.f90: In function 'force_': force.f90:84:16: warning: 't2' may be used uninitialized [-Wmaybe-uninitialized] 84 | real(8) ca,t1,t2 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvbmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvbmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genvbmatk.f90:50:17: 50 | wfmt1(1:npc,:)=wfmt(1:npc,ias,1,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genvbmatk.f90:51:22: 51 | wfmt1(npc+1:npc2,:)=wfmt(1:npc,ias,2,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genvbmatk.f90:95:18: 95 | wfmt4(1:npc2)=wfmt2(1:npc2) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c forcek.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: forcek.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined forcek.f90: In function 'forcek_': forcek.f90:42:52: warning: 'evecsv.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 42 | complex(8), allocatable :: evecfv(:,:,:),evecsv(:,:) | ^ forcek.f90:42:52: warning: 'evecsv.offset' may be used uninitialized [-Wmaybe-uninitialized] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeepsinv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeepsinv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olprad.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olprad.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c polark.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: polark.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hflocal.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hflocal.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mixbroyden.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mixbroyden.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c grad2rfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: grad2rfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c clebgor.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: clebgor.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfirctof.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfirctof.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c effmass.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: effmass.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zpotcoul.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zpotcoul.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sfacmag.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sfacmag.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c polynm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: polynm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c epsinv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: epsinv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfinpc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfinpc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zmctmu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zmctmu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zmctm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zmctm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeiad.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeiad.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genapwfr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genapwfr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengclq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengclq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c addbfsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: addbfsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genylmv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genylmv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genexpmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genexpmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c factnm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: factnm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sphcover.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sphcover.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sctovec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sctovec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genppts.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genppts.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnzg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnzg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fderiv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fderiv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genexpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genexpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genexpmat.f90: In function 'genexpmat_': genexpmat.f90:26:39: warning: 'evecsv1.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 26 | complex(8), allocatable :: evecsv1(:,:),evecsv2(:,:) | ^ genexpmat.f90:26:39: warning: 'evecsv1.offset' may be used uninitialized [-Wmaybe-uninitialized] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeforces.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeforces.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3cross.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3cross.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c match.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: match.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genspchi0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genspchi0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzrho.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzrho.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potefield.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potefield.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhoinit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhoinit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined eveqnsv.f90:100:21: 100 | wfmt6(1:npc,ist)=wfmt1(1:npc,ist) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] eveqnsv.f90: In function 'eveqnsv_': eveqnsv.f90:26:10: warning: 'a1' may be used uninitialized [-Wmaybe-uninitialized] 26 | real(8) a1,a2,a3,t1 | ^ eveqnsv.f90:26:13: warning: 'a2' may be used uninitialized [-Wmaybe-uninitialized] 26 | real(8) a1,a2,a3,t1 | ^ eveqnsv.f90:303:25: warning: 'a3' may be used uninitialized [-Wmaybe-uninitialized] 303 | deallocate(wfir1,wfir2) | ^ eveqnsv.f90:26:16: note: 'a3' was declared here 26 | real(8) a1,a2,a3,t1 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c roteuler.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: roteuler.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genrmesh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genrmesh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c splint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: splint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wavefcr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wavefcr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined wavefcr.f90: In function 'wavefcr_': wavefcr.f90:123:16: warning: 'i2' may be used uninitialized [-Wmaybe-uninitialized] 123 | i2=i2+lmmaxo | ^ wavefcr.f90:19:15: note: 'i2' was declared here 19 | integer i,i1,i2 | ^ wavefcr.f90:122:16: warning: 'i1' may be used uninitialized [-Wmaybe-uninitialized] 122 | i1=i1+lmmaxo | ^ wavefcr.f90:19:12: note: 'i1' was declared here 19 | integer i,i1,i2 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c lopzflm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: lopzflm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c brzint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: brzint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rotdmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rotdmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genylmg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genylmg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentaucr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentaucr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readinput.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readinput.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c numlist.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: numlist.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hermite.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hermite.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genfspecies.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genfspecies.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c atpstep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: atpstep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmatls.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmatls.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeengy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeengy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writechg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writechg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rbsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rbsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genlofr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genlofr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rotrfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rotrfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zftzf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zftzf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genpmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genpmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rvfcross.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rvfcross.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeinfo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeinfo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mossbauer.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mossbauer.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c initoep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: initoep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c i3minv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: i3minv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genidxlo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genidxlo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c nuclei.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: nuclei.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeefg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeefg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevsp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevsp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gencore.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gencore.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mtv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mtv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3minv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3minv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3frac.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3frac.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genapwlofr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genapwlofr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gridsize.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gridsize.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrfir.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrfir.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c geomplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: geomplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ylmroty.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ylmroty.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengvclns.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengvclns.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ssfext.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ssfext.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writestate.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writestate.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta_sq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta_sq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potxcir.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potxcir.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined potxcir.f90: In function 'potxcir_': potxcir.f90:26:45: warning: 'vxdn.dim[0].ubound' may be used uninitialized [-Wmaybe-uninitialized] 26 | real(8), allocatable :: vx(:),vxup(:),vxdn(:) | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potxc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potxc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rzfmtinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rzfmtinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhoplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhoplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c occupy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: occupy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symveca.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symveca.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c jprplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: jprplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genvmatk.f90:49:19: 49 | wfmt1(1:npc,:)=wfmt(1:npc,ias,ispn,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genvmatk.f90:54:19: 54 | wfmt2(1:npc)=vmt(1:npc,ias)*wfmt(1:npc,ias,ispn,jst) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genvmatk.f90:63:23: 63 | wfmt2(1:npc)=wfmt2(1:npc)+wfmt3(1:npc) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c geomopt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: geomopt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnss.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnss.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined eveqnss.f90: In function 'eveqnss_._omp_fn.0': eveqnss.f90:66:43: warning: 'IMAGPART_EXPR ' may be used uninitialized [-Wmaybe-uninitialized] 66 | if (ssdph.and.(ispn.eq.2)) zq=conjg(zq) | ^ eveqnss.f90:25:13: note: 'IMAGPART_EXPR ' was declared here 25 | complex(8) zq | ^ eveqnss.f90:72:63: warning: 'REALPART_EXPR ' may be used uninitialized [-Wmaybe-uninitialized] 72 | if (ssdph) wfmt1(1:npc,ist,ispn)=zq*wfmt1(1:npc,ist,ispn) | ^ eveqnss.f90:25:13: note: 'REALPART_EXPR ' was declared here 25 | complex(8) zq | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hartfock.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hartfock.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined hartfock.f90:200:17: 124 | call mpi_bcast(evalsv(:,ik),nstsv,mpi_double_precision,lp,mpicom,ierror) | 2 ...... 200 | call mpi_bcast(tlast,1,mpi_logical,0,mpicom,ierror) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (LOGICAL(4)/REAL(8)). mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfpw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfpw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlxbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlxbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlxbsek.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlxbsek.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmldbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmldbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmldbsek.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmldbsek.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradwfcr2.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradwfcr2.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oepresk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oepresk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined oepresk.f90:172:50: 172 | call rzadd(npcmt(is),za,zfmt(:,ias),rfmt(:,ias)) | 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) oepresk.f90:174:30: 174 | call rzadd(ngtot,za,zfir,rfir) | 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) oepresk.f90:81:51: 81 | call rzadd(npc,z1,zfmt1,dvxmt(:,ias)) | 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) oepresk.f90:83:65: 83 | call rzadd(npc,z1,zvfmt1(:,idm),dbxmt(:,ias,idm)) | 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) oepresk.f90: In function 'oepresk_': oepresk.f90:26:40: warning: 'zvfmt2.dim[2].stride' may be used uninitialized [-Wmaybe-uninitialized] 26 | complex(8), allocatable :: zvfmt2(:,:,:),zvfir2(:,:) | ^ oepresk.f90:26:52: warning: 'zvfir2.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 26 | complex(8), allocatable :: zvfmt2(:,:,:),zvfir2(:,:) | ^ oepresk.f90:24:47: warning: 'zvfmt1.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 24 | complex(8), allocatable :: zfmt1(:),zvfmt1(:,:) | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c addlorbcnd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: addlorbcnd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c energy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: energy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oepvcl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oepvcl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oepvclk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oepvclk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined oepvclk.f90:98:35: 55 | call genwfsv(.false.,.false.,nstsv,0,ngdgc,igfc,ngk(1,ikp),igkig(:,1,ikp), & | 2 ...... 98 | call genwfsv(.false.,.false.,nst,idx,ngdgc,igfc,ngk(1,ik),igkig(:,1,ik), & | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c polar.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: polar.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dbxcplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dbxcplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sbesseldm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sbesseldm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writehmlbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writehmlbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dielectric_bse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dielectric_bse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vecplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vecplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c nesting.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: nesting.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c emdplot3d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: emdplot3d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c emdplot2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: emdplot2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c emdplot1d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: emdplot1d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfhkintp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfhkintp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rfhkintp.f90: In function 'rfhkintp_': rfhkintp.f90:65:34: warning: 'v0[0]' may be used uninitialized [-Wmaybe-uninitialized] 65 | t2=(vhpl(1)-v0(1))*dble(ngridk(1)) | ^ rfhkintp.f90:20:13: note: 'v0[0]' was declared here 20 | real(8) v0(3),v1(3),v2(3),t1,t2 | ^ rfhkintp.f90:71:34: warning: 'v0[1]' may be used uninitialized [-Wmaybe-uninitialized] 71 | t2=(vhpl(2)-v0(2))*dble(ngridk(2)) | ^ rfhkintp.f90:20:13: note: 'v0[1]' was declared here 20 | real(8) v0(3),v1(3),v2(3),t1,t2 | ^ rfhkintp.f90:75:34: warning: 'v0[2]' may be used uninitialized [-Wmaybe-uninitialized] 75 | t2=(vhpl(3)-v0(3))*dble(ngridk(3)) | ^ rfhkintp.f90:20:13: note: 'v0[2]' was declared here 20 | real(8) v0(3),v1(3),v2(3),t1,t2 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writewfpw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writewfpw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vblocal.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vblocal.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writefsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writefsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getwfpw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getwfpw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotpt1d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotpt1d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init2.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init2.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findsymcrys.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findsymcrys.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined findsymcrys.f90: In function 'findsymcrys_': findsymcrys.f90:39:13: warning: 'v0[0]' may be used uninitialized [-Wmaybe-uninitialized] 39 | real(8) v0(3),v1(3),v2(3),t1 | ^ findsymcrys.f90:39:13: warning: 'v0[1]' may be used uninitialized [-Wmaybe-uninitialized] findsymcrys.f90:195:27: warning: 'v0[2]' may be used uninitialized [-Wmaybe-uninitialized] 195 | v1(:)=atposl(:,1,1)-v0(:) | ^ findsymcrys.f90:39:13: note: 'v0[2]' was declared here 39 | real(8) v0(3),v1(3),v2(3),t1 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotpt3d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotpt3d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c elnes.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: elnes.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fermisurfbxsf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fermisurfbxsf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genspecies.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genspecies.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeexpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeexpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writekpts.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writekpts.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfcrplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfcrplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writedos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writedos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c energykncr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: energykncr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_sp_1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_sp_1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_sp_1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_sp_1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_2a.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_2a.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_2a.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_2a.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_2b.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_2b.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_2b.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_2b.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_sp_2a.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_sp_2a.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_sp_2a.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_sp_2a.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_sp_2b.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_sp_2b.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_sp_2b.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_sp_2b.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeemd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeemd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c reademd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: reademd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c emdplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: emdplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init3.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init3.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init4.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init4.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bfieldfsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bfieldfsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c testcheck.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: testcheck.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c pade.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: pade.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wsplint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wsplint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gensocfr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gensocfr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c pades.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: pades.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genscss.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genscss.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfcmtwr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfcmtwr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c nonlinopt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: nonlinopt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writelat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writelat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhocore.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhocore.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rzfinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rzfinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readspecies.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readspecies.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findband.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findband.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c exxengy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: exxengy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentauk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentauk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradrfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradrfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c checkfsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: checkfsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genrlmv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genrlmv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mae.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mae.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegvecrf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegvecrf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zcfmtwr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zcfmtwr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfmtsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfmtsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpistl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpistl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlistl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlistl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpalo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpalo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlalo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlalo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olplolo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olplolo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmllolo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmllolo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpaa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpaa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlaa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlaa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengclg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengclg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomagsh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomagsh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c charge.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: charge.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c moment.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: moment.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfint0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfint0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mdet.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mdet.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gencfrc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gencfrc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c checkstop.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: checkstop.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genbs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genbs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfirsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfirsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtsm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtsm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradwf2.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradwf2.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c closefiles.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: closefiles.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writelinen.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writelinen.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtlm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtlm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getpmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getpmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtpack.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtpack.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtpack.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtpack.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevalfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevalfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevalfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevalfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfmtfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfmtfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putkmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putkmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getkmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getkmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putepsinv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putepsinv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getcfgq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getcfgq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevalsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevalsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevalsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevalsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevecsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevecsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevecsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevecsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genshtmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genshtmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genshtmat.f90:77:12: 77 | cbshti(:,:)=zbshti(:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genshtmat.f90:78:12: 78 | cfshti(:,:)=zfshti(:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genshtmat.f90:125:12: 125 | cbshto(:,:)=zbshto(:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genshtmat.f90:126:12: 126 | cfshto(:,:)=zfshto(:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c allatoms.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: allatoms.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevecfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevecfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevecfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevecfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writesym.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writesym.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putoccsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putoccsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getoccsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getoccsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c torque.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: torque.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findqpt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findqpt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findkpt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findkpt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genevfsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genevfsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sortidx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sortidx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c radnucl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: radnucl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrvf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrvf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeqpts.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeqpts.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rndevsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rndevsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengkvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengkvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mixlinear.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mixlinear.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writesf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writesf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengqf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengqf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genkmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genkmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genolpq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genolpq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjlgprmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjlgprmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfinterp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfinterp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fsmooth.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fsmooth.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c axangrot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: axangrot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rotaxang.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rotaxang.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wspline.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wspline.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c splined.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: splined.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findswidth.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findswidth.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findsymlat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findsymlat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writepmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writepmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genstrain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genstrain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symmetry.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symmetry.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c linengy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: linengy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writestress.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writestress.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eulerrot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eulerrot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zftwfir.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zftwfir.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rschrodint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rschrodint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegclq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegclq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegeom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegeom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writemom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writemom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c curlrvf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: curlrvf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzvclmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzvclmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjtot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjtot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c checkwrite.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: checkwrite.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjprk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjprk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c proj2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: proj2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genidxbse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genidxbse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrvfir.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrvfir.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjpr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjpr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnfvr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnfvr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentau.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentau.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjlgpr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjlgpr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writestrain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writestrain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writefermi.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writefermi.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfmtctof.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfmtctof.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findsym.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findsym.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhonorm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhonorm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvchi0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvchi0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtconj.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtconj.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta_sq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta_sq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sdelta_lr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sdelta_lr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c stheta_lr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: stheta_lr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findsymsite.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findsymsite.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genlmirep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genlmirep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writespecies.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writespecies.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomagk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomagk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrvfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrvfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wigner3jf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wigner3jf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genhvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genhvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ylmrot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ylmrot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wxcplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wxcplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c massnucl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: massnucl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c straingkq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: straingkq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c oepmain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: oepmain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdirac.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdirac.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bandstr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bandstr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sfacinit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sfacinit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findscq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findscq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plot1d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plot1d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plot2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plot2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plot3d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plot3d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c init0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: init0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readstate.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readstate.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnhf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnhf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined eveqnhf.f90:119:35: 52 | call genwfsv(.false.,.true.,nstsv,0,ngdgc,igfc,ngk(1,ikp),igkig(:,1,ikp), & | 2 ...... 119 | call genwfsv(.false.,.false.,nst,idx,ngdgc,igfc,ngk(1,ik),igkig(:,1,ik), & | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zbsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zbsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c i3mtv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: i3mtv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c spline.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: spline.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gauntyry.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gauntyry.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findnjcmax.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findnjcmax.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gndstate.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gndstate.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sstask.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sstask.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fermisurf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fermisurf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c spiralsc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: spiralsc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c atom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: atom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c maginit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: maginit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c exxengyk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: exxengyk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_c_tb09.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_c_tb09.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c moke.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: moke.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlrad.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlrad.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dos.f90: In function 'dos_': dos.f90:343:25: warning: 'elm.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 343 | lm,elm(lm,ias) | ^ dos.f90:60:50: note: 'elm.dim[1].stride' was declared here 60 | real(8), allocatable :: dt(:,:),dp(:,:,:),elm(:,:) | ^ dos.f90:343:25: warning: 'elm.offset' may be used uninitialized [-Wmaybe-uninitialized] 343 | lm,elm(lm,ias) | ^ dos.f90:60:50: note: 'elm.offset' was declared here 60 | real(8), allocatable :: dt(:,:),dp(:,:,:),elm(:,:) | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findprimcell.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findprimcell.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotpt2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotpt2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sfacrho.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sfacrho.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bdipole.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bdipole.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dielectric.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dielectric.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c elfplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: elfplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vclcore.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vclcore.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfmtwr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfmtwr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zvcldisp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zvcldisp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vecfbz.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vecfbz.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gcd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gcd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c lopzflmn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: lopzflmn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zpotclmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zpotclmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readfermi.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readfermi.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gensdmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gensdmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c symrfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: symrfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sphcrd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sphcrd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potcoul.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potcoul.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzrm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzrm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rminv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rminv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rtozfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rtozfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfsvp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfsvp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdiracint.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdiracint.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rotzflm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rotzflm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfinp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfinp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c latvstep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: latvstep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradzfmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradzfmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c cbsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: cbsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c cfsht.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: cfsht.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfmtsv_sp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfmtsv_sp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined wfmtsv_sp.f90:196:8: 196 | cf(1,:)=cf(1,:)+z*rf(1,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c wfirsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: wfirsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfsv_sp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfsv_sp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggamt_4.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggamt_4.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ggair_4.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ggair_4.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c trzhmm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: trzhmm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rvcopy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rvcopy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dolpistl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dolpistl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmlistl.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmlistl.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpaloq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpaloq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlaloq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlaloq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dolpalo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dolpalo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmlalo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmlalo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmllolo.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmllolo.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c olpaaq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: olpaaq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dolpaa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dolpaa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmlaa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmlaa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlaaq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlaaq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c initeph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: initeph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined initeph.f90:105:26: 105 | ephmkq(:,:,:,ik,iq)=ephmat(:,:,:) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dengyeph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dengyeph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gndsteph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gndsteph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gndsteph.f90:46:42: 42 | call mixerifc(mixtype,nmix,duvwx,dv,nwork,duvwx) | 2 ...... 46 | call mixerifc(mixtype,nmix,duvwx,dv,nwork,work) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/COMPLEX(8)). mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqneph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqneph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined eveqneph.f90:62:19: 60 | call mpi_bcast(evalwx(:,iq),nbph,mpi_double_precision,lp,mpicom,ierror) | 2 61 | call mpi_bcast(xnorm(:,iq),nbph,mpi_double_precision,lp,mpicom,ierror) 62 | call mpi_bcast(dxx(:,:,iq),n,mpi_double_complex,lp,mpicom,ierror) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/REAL(8)). mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlepha.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlepha.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlephb.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlephb.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c hmlephde.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: hmlephde.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getephmkq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getephmkq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ephdos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ephdos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gradrhomt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gradrhomt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendcfun.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendcfun.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendvsig.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendvsig.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c drhomagsh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: drhomagsh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c doccupy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: doccupy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dhmlrad.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dhmlrad.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendwfsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendwfsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gendwfsv.f90: In function 'gendwfsv_': gendwfsv.f90:32:58: warning: 'dwfmt1.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 32 | complex(8), allocatable :: wfmt1(:,:),wfmt2(:),dwfmt1(:,:) | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dwfmtfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dwfmtfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengqvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengqvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmatch.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmatch.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writedvs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writedvs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readdyn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readdyn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dyntask.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dyntask.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dpotks.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dpotks.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dpotxc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dpotxc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dpotxc.f90: In function 'dpotxc_': dpotxc.f90:16:44: warning: 'dbmt.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 16 | complex(8), allocatable :: dvmt(:),dbmt(:,:),zfmt(:) | ^ dpotxc.f90:16:44: warning: 'dbmt.offset' may be used uninitialized [-Wmaybe-uninitialized] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c deveqnfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: deveqnfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dpotcoul.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dpotcoul.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c drhomagk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: drhomagk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengvsmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengvsmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dforce.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dforce.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dforcek.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dforcek.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dforcek.f90: In function 'dforcek_': dforcek.f90:30:51: warning: 'devecsv.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 30 | complex(8), allocatable :: evecsv(:,:),devecsv(:,:) | ^ dforcek.f90:30:51: warning: 'devecsv.offset' may be used uninitialized [-Wmaybe-uninitialized] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynqtor.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynqtor.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynevs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynevs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phonon.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phonon.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined phonon.f90:119:41: 80 | call mixerifc(mtype,nmix,dvsbs,ddv,nwork,dvsbs) | 2 ...... 119 | call mixerifc(mtype,nmix,dvsbs,ddv,nwork,work) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/COMPLEX(8)). phonon.f90:255:17: 210 | call mpi_bcast(devalfv(:,:,ik),n,mpi_double_precision,lp,mpicom,ierror) | 2 ...... 255 | call mpi_bcast(tlast,1,mpi_logical,0,mpicom,ierror) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (LOGICAL(4)/REAL(8)). mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynrtoq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynrtoq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c mcmillan.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: mcmillan.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genephmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genephmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengkqvec.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengkqvec.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genmcph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genmcph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putdevecfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putdevecfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getdevecfv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getdevecfv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putdevecsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putdevecsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getdevecsv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getdevecsv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phononsc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phononsc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genscph.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genscph.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phdisp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phdisp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynsymapp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynsymapp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynsym.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynsym.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynev.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynev.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phdos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phdos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sumrule.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sumrule.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writephn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writephn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dynfext.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dynfext.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegamma.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegamma.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readgamma.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readgamma.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phlwidth.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phlwidth.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c alpha2f.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: alpha2f.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writelambda.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writelambda.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ephcouple.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ephcouple.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eliashberg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eliashberg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c phscdvs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: phscdvs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readdvs.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readdvs.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readalpha2f.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readalpha2f.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendsocfr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendsocfr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bornechg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bornechg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bectask.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bectask.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c becfext.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: becfext.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putephmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putephmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getephmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getephmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_pzca.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_pzca.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_pwca.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_pwca.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_pbe.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_pbe.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_am05.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_am05.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_xalpha.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_xalpha.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_wc06.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_wc06.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c x_wc06.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: x_wc06.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c x_pbe.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: x_pbe.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c c_pbe.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: c_pbe.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c c_pbe_gcor.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: c_pbe_gcor.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c xc_vbh.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: xc_vbh.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fxc_pwca.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fxc_pwca.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c k_tfvw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: k_tfvw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c k_tfvw_sp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: k_tfvw_sp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c k_tfvw1.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: k_tfvw1.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c k_vwlb.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: k_vwlb.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendmatmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendmatmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genveedu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genveedu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tm2todm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tm2todm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tm3todm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tm3todm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmtotm3.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmtotm3.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writedftu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writedftu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sbesseli.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sbesseli.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c shankeli.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: shankeli.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genfdu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genfdu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genfdufr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genfdufr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c engyfdu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: engyfdu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findlambda.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findlambda.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vmatmtsc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vmatmtsc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvmatmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvmatmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vmatmtdu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vmatmtdu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vmatmtftm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vmatmtftm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fyukawa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fyukawa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fyukawa0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fyukawa0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readdmatmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readdmatmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetm3.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetm3.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gendmftm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gendmftm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeftm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeftm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetm3td.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetm3td.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwkpr0.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwkpr0.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tm3rtoz.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tm3rtoz.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmft.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmft.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmwriteengy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmwriteengy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmminc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmminc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmvaryc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmvaryc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdedc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdedc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmengyxc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmengyxc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rdmengyxc.f90: In function 'rdmengyxc_': rdmengyxc.f90:73:45: warning: 't2' may be used uninitialized [-Wmaybe-uninitialized] 73 | engyx=engyx-t2*vclijji(ist2,ist1,ik2) | ^ rdmengyxc.f90:24:13: note: 't2' was declared here 24 | real(8) t1,t2,t3,t4 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmminn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmminn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmvaryn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmvaryn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdkdc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdkdc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmenergy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmenergy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmwritededn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmwritededn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdedn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdedn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdexcdn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdexcdn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rdmdexcdn.f90: In function 'rdmdexcdn_': rdmdexcdn.f90:77:63: warning: 't2' may be used uninitialized [-Wmaybe-uninitialized] 77 | dedn(ist2,ik2)=dedn(ist2,ik2)+t2*vclijji(ist2,ist1,ik2) | ^ rdmdexcdn.f90:31:13: note: 't2' was declared here 31 | real(8) t1,t2,t3,t4 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvclijjk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvclijjk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getvclijji.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getvclijji.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getvclijjk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getvclijjk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writevclijji.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writevclijji.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writevclijjk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writevclijjk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdexcdc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdexcdc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rdmdexcdc.f90: In function 'rdmdexcdc_': rdmdexcdc.f90:80:40: warning: 't2' may be used uninitialized [-Wmaybe-uninitialized] 80 | vclijjk(ist1,ist3,ist4,ik2) | ^ rdmdexcdc.f90:29:13: note: 't2' was declared here 29 | real(8) t1,t2,t3 | ^ mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmdtsdn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmdtsdn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmentropy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmentropy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rdmeval.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rdmeval.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvclijji.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvclijji.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwdmat.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwdmat.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwlocal.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwlocal.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwgw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwgw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c ksinvert.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: ksinvert.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gtwsum.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gtwsum.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c minf_nm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: minf_nm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c acpole.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: acpole.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwrhomag.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwrhomag.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwdmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwdmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwefermi.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwefermi.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dysonr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dysonr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwsefm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwsefm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putgwsefm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putgwsefm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getgwsefm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getgwsefm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeigw.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeigw.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c polefit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: polefit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwchgk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwchgk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwsefmk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwsefmk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwspecf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwspecf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegwsf.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegwsf.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c acgwse.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: acgwse.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fmin_nm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fmin_nm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfpole.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfpole.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwbandstr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwbandstr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gwscrho.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gwscrho.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c atptstep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: atptstep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potkst.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potkst.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tdbackup.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tdbackup.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetimes.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetimes.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readtimes.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readtimes.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gentimes.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gentimes.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readafieldt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readafieldt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genjr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genjr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tddft.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tddft.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c timestep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: timestep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined timestep.f90:126:34: 124 | call mpi_allreduce(mpi_in_place,engykn,1,mpi_double_precision,mpi_sum,mpicom,& | 2 125 | ierror) 126 | call mpi_allreduce(mpi_in_place,jtot,3,mpi_double_precision,mpi_sum,mpicom, & | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tddftlr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tddftlr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genhmlt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genhmlt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetddos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetddos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeafpdt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeafpdt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readafindt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readafindt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvfxc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvfxc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genfxcr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genfxcr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genfxcr.f90: In function 'genfxcr_': genfxcr.f90:18:57: warning: 'mag.dim[1].stride' may be used uninitialized [-Wmaybe-uninitialized] 18 | real(8), allocatable :: rho(:),rhoup(:),rhodn(:),mag(:,:) | ^ genfxcr.f90:18:57: warning: 'mag.offset' may be used uninitialized [-Wmaybe-uninitialized] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tdtemp.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tdtemp.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetdlsj.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetdlsj.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genspfxcr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genspfxcr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genvfxcg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genvfxcg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tddftsplr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tddftsplr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genspfxcg.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genspfxcg.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genafieldt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genafieldt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writetddft.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writetddft.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dielectric_tdrt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dielectric_tdrt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readjtot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readjtot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c afindtstep.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: afindtstep.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genefieldt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genefieldt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c energytd.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: energytd.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c engyknk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: engyknk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readforcet.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readforcet.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c tdrestart.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: tdrestart.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readdatposc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readdatposc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writedatposc.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writedatposc.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhostatic.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhostatic.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c jtotk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: jtotk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhosplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhosplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c bornecdyn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: bornecdyn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c becforce.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: becforce.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfirctof.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfirctof.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevalu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevalu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writekpa.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writekpa.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genhdbulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genhdbulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vblocalu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vblocalu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c chargeu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: chargeu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c addbfsmu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: addbfsmu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c momentu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: momentu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c occupyulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: occupyulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potksu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potksu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writevclr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writevclr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzvmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzvmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genzvmatk.f90:48:19: 48 | wfmt1(1:npc)=zvmt(1:npc,ias)*wfmt(1:npc,ias,ispn,jst) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genzvbmatk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genzvbmatk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined genzvbmatk.f90:161:10: 161 | wf21(i)=(zv(i)+zb(i))*wf11(i) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genzvbmatk.f90:162:10: 162 | wf22(i)=(zv(i)-zb(i))*wf12(i) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genzvbmatk.f90:131:10: 131 | wf21(i)=(zv(i)+zb3(i))*wf11(i)+(zb1(i)-z1)*wf12(i) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] genzvbmatk.f90:132:10: 132 | wf22(i)=(zv(i)-zb3(i))*wf12(i)+(zb1(i)+z1)*wf11(i) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to COMPLEX(4) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomagq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomagq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeengyu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeengyu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rfzfftq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rfzfftq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined rfzfftq.f90:113:36: 68 | call mpi_allreduce(mpi_in_place,zfmt,n,mpi_double_complex,mpi_sum,mpicom, & | 2 ...... 113 | call mpi_allreduce(mpi_in_place,rfmt,n,mpi_double_precision,mpi_sum, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/COMPLEX(8)). mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhocoreu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhocoreu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhomaguk.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhomaguk.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genhmlu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genhmlu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potxcu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potxcu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeinfou.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeinfou.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c zfplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: zfplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c vclqinit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: vclqinit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writechgrmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writechgrmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c initulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: initulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writemomrmt.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writemomrmt.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writestulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writestulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readstulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readstulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potefieldu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potefieldu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c puthdbulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: puthdbulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gethdbulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gethdbulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potuinit.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potuinit.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readvclr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readvclr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genkpakq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genkpakq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotu1d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotu1d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotu2d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotu2d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotu3d.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotu3d.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gndstulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gndstulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined gndstulr.f90:79:42: 75 | call mixerifc(mixtype,nmix,vsbsq,dv,nwork,vsbsq) | 2 ...... 79 | call mixerifc(mixtype,nmix,vsbsq,dv,nwork,work) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/COMPLEX(8)). gndstulr.f90:242:17: 150 | call mpi_bcast(evalu(:,ik0),nstulr,mpi_double_precision,lp,mpicom,ierror) | 2 ...... 242 | call mpi_bcast(tlast,1,mpi_logical,0,mpicom,ierror) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (LOGICAL(4)/REAL(8)). mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c plotulr.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: plotulr.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potuplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potuplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c potcoulu.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: potcoulu.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c rhouplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: rhouplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c maguplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: maguplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c initw90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: initw90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90win.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90win.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90eig.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90eig.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c setupw90.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: setupw90.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90mmn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90mmn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writew90spn.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writew90spn.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmatuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmatuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dmatuv.f90:21:8: 21 | vn(i)=dot_product(v(:,i),v(:,i)) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to REAL(8) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c dmatwx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: dmatwx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined dmatwx.f90:19:8: 19 | xn(i)=dot_product(x(:,i),x(:,i)) | 1 Warning: Possible change of value in conversion from COMPLEX(8) to REAL(8) at (1) [-Wconversion] mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveqnwxy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveqnwxy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevaluv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevaluv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c occupyuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: occupyuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c genwfuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: genwfuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevaluv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevaluv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevaluv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevaluv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevecuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevecuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevecuv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevecuv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevecwxy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevecwxy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevecwxy.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevecwxy.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c putevalwx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: putevalwx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getevalwx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getevalwx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c aceplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: aceplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writeevalwx.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writeevalwx.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -o elk modmain.o modmpi.o modramdisk.o libxcf90.o libxcifc.o modxcifc.o modfxcifc.o moddftu.o modrdm.o modphonon.o modtest.o modrandom.o modstore.o modpw.o modvars.o modtddft.o modgw.o modulr.o modbog.o moddelf.o modomp.o mkl_stub.o mkl_init.o oblas_init.o blis_stub.o blis_init.o w90_stub.o modw90.o zfftifc_fftw.o elk.o r3mm.o r3mtm.o r3mmt.o r3vo.o gengvec.o wigner3j.o gengvc.o potnucl.o zfmtint.o rfmtint.o genvsig.o rfmtinp.o findngkmax.o potks.o mtdmin.o rfcopy.o rhomagv.o eveqn.o genffacgp.o unitary.o zmdet.o rfmtftoc.o zminv.o symrf.o genvmat.o writeeval.o mixerifc.o splinew.o nfftifc.o symdmat.o z2mm.o z2mctm.o z2mmct.o axangsu2.o gradzvcln.o gentpmae.o zfcmtwr.o projsbf.o gradzf.o timesec.o zfmtftoc.o ztorfmt.o zfmtctof.o eveqnfvz.o energynn.o gaunt.o potxcmt.o sdelta_mp.o stheta_mp.o sdelta_fd.o stheta_fd.o writelsj.o eveqnzh.o gensmatk.o gensfacgp.o rhomag.o wsplintp.o checkmt.o reciplat.o gradrf.o genzfrm.o mixadapt.o zftrf.o sbessel.o gengclgq.o gencfun.o factr.o genstress.o force.o genvbmatk.o forcek.o writeepsinv.o olprad.o polark.o zfmtinp.o hflocal.o mixbroyden.o grad2rfmt.o clebgor.o rfirctof.o effmass.o zpotcoul.o sfacmag.o polynm.o epsinv.o rfinpc.o zmctmu.o zmctm.o writeiad.o genapwfr.o gengclq.o addbfsm.o genylmv.o olpfv.o hmlfv.o genexpmt.o rfinp.o factnm.o sphcover.o sctovec.o genppts.o eveqnzg.o fderiv.o genpmat.o genexpmat.o writeforces.o r3cross.o match.o genspchi0.o genzrho.o potefield.o rhoinit.o eveqnsv.o roteuler.o genrmesh.o splint.o wavefcr.o lopzflm.o brzint.o rotdmat.o genylmg.o gentaucr.o readinput.o numlist.o hermite.o genfspecies.o atpstep.o dmatls.o writeengy.o writechg.o rbsht.o rfsht.o genlofr.o rotrfmt.o zftzf.o genpmatk.o rvfcross.o writeinfo.o mossbauer.o initoep.o i3minv.o r3mv.o genidxlo.o nuclei.o writeefg.o writeevsp.o gencore.o r3mtv.o r3minv.o r3frac.o genapwlofr.o gridsize.o symrfir.o geomplot.o ylmroty.o gengvclns.o ssfext.o writestate.o sdelta_sq.o potxcir.o potxc.o rzfmtinp.o rhoplot.o occupy.o symveca.o jprplot.o genvmatk.o geomopt.o eveqnss.o hartfock.o potplot.o genwfpw.o hmlxbse.o hmlxbsek.o hmldbse.o hmldbsek.o gradwfcr2.o oepresk.o addlorbcnd.o energy.o wfplot.o oepvcl.o oepvclk.o polar.o dbxcplot.o sbesseldm.o writehmlbse.o dielectric_bse.o vecplot.o nesting.o writeevbse.o emdplot3d.o emdplot2d.o emdplot1d.o rfhkintp.o writewfpw.o vblocal.o writefsm.o getwfpw.o plotpt1d.o init1.o init2.o findsymcrys.o plotpt3d.o elnes.o fermisurfbxsf.o genspecies.o writeexpmat.o writekpts.o wfcrplot.o writedos.o energykncr.o ggamt_1.o ggair_1.o ggamt_sp_1.o ggair_sp_1.o ggamt_2a.o ggair_2a.o ggamt_2b.o ggair_2b.o ggamt_sp_2a.o ggair_sp_2a.o ggamt_sp_2b.o ggair_sp_2b.o writeemd.o reademd.o emdplot.o init3.o init4.o bfieldfsm.o testcheck.o pade.o wsplint.o gensocfr.o pades.o genscss.o rfcmtwr.o nonlinopt.o writelat.o rhocore.o rzfinp.o readspecies.o findband.o exxengy.o gentauk.o gradrfmt.o checkfsm.o genrlmv.o mae.o writegvecrf.o zcfmtwr.o wfmtsv.o olpistl.o hmlistl.o olpalo.o hmlalo.o olplolo.o hmllolo.o olpaa.o hmlaa.o gengclg.o rhomagsh.o charge.o moment.o rfint0.o r3mdet.o gencfrc.o checkstop.o genbs.o rfirsm.o rfmtsm.o rfint.o gradwf2.o closefiles.o writelinen.o rfmtlm.o putpmat.o getpmat.o rfmtpack.o zfmtpack.o putevalfv.o getevalfv.o wfmtfv.o putkmat.o getkmat.o putepsinv.o getcfgq.o putevalsv.o getevalsv.o getevecsv.o putevecsv.o genshtmat.o allatoms.o putevecfv.o getevecfv.o writesym.o putoccsv.o getoccsv.o torque.o findqpt.o findkpt.o genevfsv.o genwfsv.o sdelta.o stheta.o sortidx.o symmat.o radnucl.o symrvf.o writeqpts.o rndevsv.o gengkvec.o mixlinear.o writesf.o gengqf.o genkmat.o genolpq.o genjlgprmt.o rfinterp.o fsmooth.o axangrot.o rotaxang.o wspline.o splined.o findswidth.o findsymlat.o writepmat.o genstrain.o symmetry.o linengy.o writestress.o eulerrot.o zftwfir.o rschrodint.o writegclq.o writegeom.o writemom.o gendmat.o curlrvf.o genzvclmt.o genjtot.o symvec.o checkwrite.o genjprk.o proj2d.o genidxbse.o symrvfir.o genjpr.o eveqnfvr.o gentau.o genjlgpr.o writestrain.o writefermi.o rfmtctof.o findsym.o zfsht.o rhonorm.o genvchi0.o zfmtconj.o stheta_sq.o sdelta_lr.o stheta_lr.o findsymsite.o genlmirep.o writespecies.o rhomagk.o symrvfmt.o wigner3jf.o genhvec.o ylmrot.o wxcplot.o massnucl.o gendmatk.o rfplot.o straingkq.o eveqnit.o oepmain.o rdirac.o bandstr.o sfacinit.o findscq.o plot1d.o plot2d.o plot3d.o init0.o readstate.o eveqnhf.o zbsht.o i3mtv.o spline.o gauntyry.o findnjcmax.o gndstate.o sstask.o fermisurf.o spiralsc.o atom.o maginit.o exxengyk.o xc_c_tb09.o moke.o hmlrad.o dos.o findprimcell.o plotpt2d.o sfacrho.o bdipole.o dielectric.o elfplot.o vclcore.o zfmtwr.o zvcldisp.o vecfbz.o gcd.o lopzflmn.o zpotclmt.o readfermi.o gensdmat.o symrfmt.o sphcrd.o potcoul.o genzrm.o rminv.o rtozfmt.o genwfsvp.o rdiracint.o rotzflm.o zfinp.o latvstep.o gradzfmt.o eveqnfv.o cbsht.o cfsht.o wfmtsv_sp.o wfirsv.o genwfsv_sp.o ggamt_4.o ggair_4.o trzhmm.o rvcopy.o dolpistl.o dhmlistl.o olpaloq.o hmlaloq.o dolpalo.o dhmlalo.o dhmllolo.o olpaaq.o dolpaa.o dhmlaa.o hmlaaq.o initeph.o dengyeph.o gndsteph.o eveqneph.o hmlepha.o hmlephb.o hmlephde.o getephmkq.o ephdos.o gradrhomt.o gendcfun.o gendvsig.o drhomagsh.o doccupy.o dhmlrad.o gendwfsv.o dwfmtfv.o gengqvec.o dmatch.o writedvs.o readdyn.o dyntask.o dpotks.o dpotxc.o deveqnfv.o dpotcoul.o drhomagk.o gengvsmt.o dforce.o dforcek.o dynqtor.o dynevs.o phonon.o dynrtoq.o mcmillan.o genephmat.o gengkqvec.o genmcph.o putdevecfv.o getdevecfv.o putdevecsv.o getdevecsv.o phononsc.o genscph.o phdisp.o dynsymapp.o dynsym.o dynev.o phdos.o sumrule.o writephn.o dynfext.o writegamma.o readgamma.o phlwidth.o alpha2f.o writelambda.o ephcouple.o eliashberg.o phscdvs.o readdvs.o readalpha2f.o gendsocfr.o bornechg.o bectask.o becfext.o putephmat.o getephmat.o xc_pzca.o xc_pwca.o xc_pbe.o xc_am05.o xc_xalpha.o xc_wc06.o x_wc06.o x_pbe.o c_pbe.o c_pbe_gcor.o xc_vbh.o fxc_pwca.o k_tfvw.o k_tfvw_sp.o k_tfvw1.o k_vwlb.o gendmatmt.o genveedu.o tm2todm.o tm3todm.o dmtotm3.o writedftu.o sbesseli.o shankeli.o genfdu.o genfdufr.o engyfdu.o findlambda.o vmatmtsc.o genvmatmt.o vmatmtdu.o vmatmtftm.o fyukawa.o fyukawa0.o readdmatmt.o writetm.o writetm3.o gendmftm.o writeftm.o writetm3td.o genwkpr0.o tm3rtoz.o rdmft.o rdmwriteengy.o rdmminc.o rdmvaryc.o rdmdedc.o rdmengyxc.o rdmminn.o rdmvaryn.o rdmdkdc.o rdmenergy.o rdmwritededn.o rdmdedn.o rdmdexcdn.o genvclijjk.o getvclijji.o getvclijjk.o writevclijji.o writevclijjk.o rdmdexcdc.o rdmdtsdn.o rdmentropy.o rdmeval.o genvclijji.o gwdmat.o gwlocal.o genwgw.o ksinvert.o gtwsum.o minf_nm.o acpole.o gwrhomag.o gwdmatk.o gwefermi.o dysonr.o gwsefm.o putgwsefm.o getgwsefm.o writeigw.o polefit.o gwchgk.o gwsefmk.o gwspecf.o writegwsf.o acgwse.o fmin_nm.o zfpole.o gwbandstr.o gwscrho.o atptstep.o potkst.o tdbackup.o writetimes.o readtimes.o gentimes.o readafieldt.o genjr.o tddft.o timestep.o tddftlr.o genhmlt.o writetddos.o writeafpdt.o readafindt.o genvfxc.o genfxcr.o tdtemp.o writetdlsj.o genspfxcr.o genvfxcg.o tddftsplr.o genspfxcg.o genafieldt.o writetddft.o dielectric_tdrt.o readjtot.o afindtstep.o genefieldt.o energytd.o engyknk.o readforcet.o tdrestart.o readdatposc.o writedatposc.o rhostatic.o jtotk.o rhosplot.o bornecdyn.o becforce.o zfirctof.o writeevalu.o writekpa.o genhdbulr.o vblocalu.o chargeu.o addbfsmu.o momentu.o occupyulr.o potksu.o writevclr.o genzvmatk.o genzvbmatk.o rhomagq.o writeengyu.o rfzfftq.o rhocoreu.o eveqnulr.o rhomaguk.o genhmlu.o potxcu.o writeinfou.o zfplot.o vclqinit.o writechgrmt.o initulr.o writemomrmt.o writestulr.o readstulr.o potefieldu.o puthdbulr.o gethdbulr.o potuinit.o readvclr.o genkpakq.o plotu1d.o plotu2d.o plotu3d.o gndstulr.o plotulr.o potuplot.o potcoulu.o rhouplot.o maguplot.o initw90.o writew90.o writew90win.o writew90eig.o setupw90.o writew90mmn.o writew90spn.o dmatuv.o dmatwx.o eveqnuv.o eveqnwxy.o writeevaluv.o occupyuv.o genwfuv.o putevaluv.o getevaluv.o putevecuv.o getevecuv.o putevecwxy.o getevecwxy.o putevalwx.o getevalwx.o aceplot.o writeevalwx.o -L/usr/lib64 -lflexiblas -L/usr/lib64 -lfftw3 \ -L/usr/lib64 -lxc -lxcf90 fmin_nm.f90:15:23: warning: type of 'polefit' does not match original declaration [-Wlto-type-mismatch] 15 | fmin_nm=polefit(rd,x) | ^ polefit.f90:6:24: note: 'polefit' was previously declared here 6 | real(8) function polefit(zfm,c) | ^ polefit.f90:6:24: note: code may be misoptimized unless '-fno-strict-aliasing' is used acpole.f90:64:31: warning: type of 'zfpole' does not match original declaration [-Wlto-type-mismatch] 64 | zr(iw)=zfpole(x(:,1),zwr(iw)) | ^ zfpole.f90:6:31: note: 'zfpole' was previously declared here 6 | pure complex(8) function zfpole(c,z) | ^ zfpole.f90:6:31: note: code may be misoptimized unless '-fno-strict-aliasing' is used acpole.f90:30:38: warning: type of 'minf_nm' does not match original declaration [-Wlto-type-mismatch] 30 | call minf_nm(1,zm,n2,x,maxit,iter,eps) | ^ minf_nm.f90:6:18: note: 'minf_nm' was previously declared here 6 | subroutine minf_nm(id,rd,n,x,maxit,iter,eps) | ^ minf_nm.f90:6:18: note: code may be misoptimized unless '-fno-strict-aliasing' is used findsymsite.f90:29:75: warning: type of 'findsym' does not match original declaration [-Wlto-type-mismatch] 29 | call findsym(apl,apl,nsymsite(ias),lsplsyms(:,ias),lspnsyms(:,ias),iea) | ^ findsym.f90:9:18: note: 'findsym' was previously declared here 9 | subroutine findsym(apl1,apl2,nsym,lspl,lspn,iea) | ^ findsym.f90:9:18: note: code may be misoptimized unless '-fno-strict-aliasing' is used chargeu.f90:36:34: warning: type of 'ddot' does not match original declaration [-Wlto-type-mismatch] 36 | t1=ddot(ngtc,rhoqir(:,1),2,cfrc,1) | ^ zmctmu.f90:29:46: note: 'ddot' was previously declared here 29 | c(i,j)=c(i,j)+ddot(l2,a(:,i),1,b(:,j),1) | ^ zmctmu.f90:29:46: note: code may be misoptimized unless '-fno-strict-aliasing' is used gndsteph.f90:42:48: warning: type of 'mixerifc' does not match original declaration [-Wlto-type-mismatch] 42 | call mixerifc(mixtype,nmix,duvwx,dv,nwork,duvwx) | ^ mixerifc.f90:6:19: note: 'mixerifc' was previously declared here 6 | subroutine mixerifc(mtype,n,v,dv,nwork,work) | ^ mixerifc.f90:6:19: note: code may be misoptimized unless '-fno-strict-aliasing' is used atpstep.f90:50:61: warning: type of 'mpi_bcast' does not match original declaration [-Wlto-type-mismatch] 50 | call mpi_bcast(atposc,n,mpi_double_precision,0,mpicom,ierror) | ^ geomopt.f90:108:67: warning: type of 'mpi_bcast' does not match original declaration [-Wlto-type-mismatch] 108 | call mpi_bcast(forcemax,1,mpi_double_precision,0,mpicom,ierror) | ^ checkstop.f90:22:51: warning: type of 'mpi_bcast' does not match original declaration [-Wlto-type-mismatch] 22 | call mpi_bcast(tstop,1,mpi_logical,0,mpicom,ierror) | ^ sstask.f90:32:50: warning: type of 'mpi_bcast' does not match original declaration [-Wlto-type-mismatch] 32 | call mpi_bcast(iqss,1,mpi_integer,0,mpicom,ierror) | ^ genvmat.f90:81:70: note: 'mpi_bcast' was previously declared here 81 | call mpi_bcast(vmat(:,:,ik),n,mpi_double_complex,lp,mpicom,ierror) | ^ genvmat.f90:81:70: note: code may be misoptimized unless '-fno-strict-aliasing' is used epsinv.f90:58:12: warning: type of 'mpi_allreduce' does not match original declaration [-Wlto-type-mismatch] 58 | ierror) | ^ writehmlbse.f90:85:19: warning: type of 'mpi_allreduce' does not match original declaration [-Wlto-type-mismatch] 85 | mpicom,ierror) | ^ rhomagv.f90:98:10: note: 'mpi_allreduce' was previously declared here 98 | ierror) | ^ rhomagv.f90:98:10: note: code may be misoptimized unless '-fno-strict-aliasing' is used modramdisk.f90:264:47: warning: type of 'rvcopy' does not match original declaration [-Wlto-type-mismatch] 264 | call rvcopy(3,file(fnum)%rec(irec)%dat(i),v1) | ^ modramdisk.f90:189:47: warning: type of 'rvcopy' does not match original declaration [-Wlto-type-mismatch] 189 | call rvcopy(3,v1,file(fnum)%rec(irec)%dat(i)) | ^ rvcopy.f90:6:22: note: 'rvcopy' was previously declared here 6 | pure subroutine rvcopy(n,x,y) | ^ rvcopy.f90:6:22: note: code may be misoptimized unless '-fno-strict-aliasing' is used make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' cd src/eos; make make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src/eos' mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modmain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modmain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c eveos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: eveos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c pveos.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: pveos.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readinput.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readinput.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c getedata.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: getedata.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fitdata.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fitdata.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c output.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: output.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c minf_nm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: minf_nm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c fmin_nm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: fmin_nm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -o eos modmain.o eos.o eveos.o pveos.o readinput.o getedata.o fitdata.o output.o minf_nm.o fmin_nm.o make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src/eos' cd src/spacegroup; make make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src/spacegroup' mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c modmain.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: modmain.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c main.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: main.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c readinput.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: readinput.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gencrystal.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gencrystal.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c sgsymb.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: sgsymb.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c seitzgen.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: seitzgen.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c gengroup.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: gengroup.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c seitzeq.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: seitzeq.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c seitzmul.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: seitzmul.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c writegeom.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: writegeom.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c geomplot.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: geomplot.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c findprimcell.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: findprimcell.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3frac.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3frac.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3cross.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3cross.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3minv.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3minv.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -c r3mm.f90 f951: Warning: '-Werror=' argument '-Werror=format-security' is not valid for Fortran f951: Warning: -D_FORTIFY_SOURCE not defined annobin: r3mm.f90: Warning: -D_GLIBCXX_ASSERTIONS not defined mpif90 -fopenmp -fallow-argument-mismatch -I/usr/lib64/gfortran/modules/mpich -I/usr/lib64/gfortran/modules -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -o spacegroup modmain.o main.o readinput.o gencrystal.o sgsymb.o seitzgen.o gengroup.o seitzeq.o seitzmul.o writegeom.o geomplot.o findprimcell.o r3frac.o r3mv.o r3cross.o r3minv.o r3mm.o make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src/spacegroup' + mv src/elk elk_mpich + /usr/bin/make clean cd src; make cleanall make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' cd BLAS; make clean /bin/sh: line 1: cd: BLAS: No such file or directory make[2]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' rm -f *.o *.mod *~ ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf *.tex *.toc *.out elk make[2]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' cd LAPACK; make clean /bin/sh: line 1: cd: LAPACK: No such file or directory make[2]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' rm -f *.o *.mod *~ ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf *.tex *.toc *.out elk make[2]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' cd fftlib; make clean /bin/sh: line 1: cd: fftlib: No such file or directory make[2]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' rm -f *.o *.mod *~ ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf *.tex *.toc *.out elk make[2]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' make clean make[2]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src' rm -f *.o *.mod *~ ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf *.tex *.toc *.out elk make[2]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src' cd src/eos; make clean make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src/eos' rm -f *.o *.mod *~ fort.* ifc* *.gcno *.OUT gmon.out eos make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src/eos' cd src/spacegroup; make clean make[1]: Entering directory '/builddir/build/BUILD/elk-8.3.22/src/spacegroup' rm -f *.o *.mod *~ fort.* ifc* *.gcno *.OUT *.xsf *.ascii gmon.out \ *.aux *.dvi *.log *.pdf *.tex *.toc *.out spacegroup make[1]: Leaving directory '/builddir/build/BUILD/elk-8.3.22/src/spacegroup' rm -f *.o *.mod *~ fort.* ifc* *.gcno *.exe + . /etc/profile.d/modules.sh ++ . /etc/profile.d/00-modulepath.sh +++ '[' -z /etc/modulefiles:/usr/share/modulefiles:/usr/share/modulefiles/Linux:/usr/share/modulefiles/Core:/usr/share/lmod/lmod/modulefiles/Core ']' +++ : ++ '[' -z '' ']' ++ LMOD_ALLOW_ROOT_USE=yes ++ '[' -n '' ']' ++ '[' yes '!=' yes ']' ++ '[' -z /usr/share/modulefiles ']' ++ findExec READLINK_CMD /usr/bin/readlink readlink ++ Nm=READLINK_CMD ++ confPath=/usr/bin/readlink ++ execNm=readlink ++ eval READLINK_CMD=/usr/bin/readlink +++ READLINK_CMD=/usr/bin/readlink ++ '[' '!' -x /usr/bin/readlink ']' ++ unset Nm confPath execNm ++ findExec PS_CMD /usr/bin/ps ps ++ Nm=PS_CMD ++ confPath=/usr/bin/ps ++ execNm=ps ++ eval PS_CMD=/usr/bin/ps +++ PS_CMD=/usr/bin/ps ++ '[' '!' -x /usr/bin/ps ']' ++ unset Nm confPath execNm ++ findExec EXPR_CMD /usr/bin/expr expr ++ Nm=EXPR_CMD ++ confPath=/usr/bin/expr ++ execNm=expr ++ eval EXPR_CMD=/usr/bin/expr +++ EXPR_CMD=/usr/bin/expr ++ '[' '!' -x /usr/bin/expr ']' ++ unset Nm confPath execNm ++ findExec BASENAME_CMD /usr/bin/basename basename ++ Nm=BASENAME_CMD ++ confPath=/usr/bin/basename ++ execNm=basename ++ eval BASENAME_CMD=/usr/bin/basename +++ BASENAME_CMD=/usr/bin/basename ++ '[' '!' -x /usr/bin/basename ']' ++ unset Nm confPath execNm ++ unset -f findExec ++ '[' -f /proc/50/exe ']' +++ /usr/bin/readlink /proc/50/exe ++ my_shell=/usr/bin/bash +++ /usr/bin/expr /usr/bin/bash : '-*\(.*\)' ++ my_shell=/usr/bin/bash +++ /usr/bin/basename /usr/bin/bash ++ my_shell=bash ++ case ${my_shell} in ++ '[' -f /usr/share/lmod/lmod/init/bash ']' ++ . /usr/share/lmod/lmod/init/bash +++ '[' -z '' ']' +++ case "$-" in +++ __lmod_vx=x +++ '[' -n x ']' +++ set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for this output (/usr/share/lmod/lmod/init/bash) Shell debugging restarted +++ unset __lmod_vx ++ unset my_shell PS_CMD EXPR_CMD BASENAME_CMD MODULEPATH_INIT LMOD_ALLOW_ROOT_USE READLINK_CMD + module unload mpi/mpich-ppc64le + local __lmod_my_status + local __lmod_sh_dbg + '[' -z '' ']' + case "$-" in + __lmod_sh_dbg=x + '[' -n x ']' + set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for Lmod's output Shell debugging restarted + return 0 + RPM_EC=0 ++ jobs -p + exit 0 Executing(%install): /bin/sh -e /var/tmp/rpm-tmp.GIOV62 + umask 022 + cd /builddir/build/BUILD + '[' /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le '!=' / ']' + rm -rf /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le ++ dirname /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le + mkdir -p /builddir/build/BUILDROOT + mkdir /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le + CFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + export CFLAGS + CXXFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + export CXXFLAGS + FFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -I/usr/lib64/gfortran/modules' + export FFLAGS + FCFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -I/usr/lib64/gfortran/modules' + export FCFLAGS + LDFLAGS='-Wl,-z,relro -Wl,--as-needed -Wl,-z,now -specs=/usr/lib/rpm/redhat/redhat-hardened-ld -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -Wl,--build-id=sha1 -Wl,-dT,/builddir/build/BUILD/elk-8.3.22/.package_note-elk-8.3.22-1.fc37.ppc64le.ld' + export LDFLAGS + LT_SYS_LIBRARY_PATH=/usr/lib64: + export LT_SYS_LIBRARY_PATH + CC=gcc + export CC + CXX=g++ + export CXX + cd elk-8.3.22 + mkdir -p /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/etc + mkdir -p /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/bin + install -p -m 755 elk elk-eos elk-spacegroup /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/bin + . /etc/profile.d/modules.sh ++ . /etc/profile.d/00-modulepath.sh +++ '[' -z /etc/modulefiles:/usr/share/modulefiles:/usr/share/modulefiles/Linux:/usr/share/modulefiles/Core:/usr/share/lmod/lmod/modulefiles/Core ']' +++ : ++ '[' -z '' ']' ++ LMOD_ALLOW_ROOT_USE=yes ++ '[' -n '' ']' ++ '[' yes '!=' yes ']' ++ '[' -z /usr/share/modulefiles ']' ++ findExec READLINK_CMD /usr/bin/readlink readlink ++ Nm=READLINK_CMD ++ confPath=/usr/bin/readlink ++ execNm=readlink ++ eval READLINK_CMD=/usr/bin/readlink +++ READLINK_CMD=/usr/bin/readlink ++ '[' '!' -x /usr/bin/readlink ']' ++ unset Nm confPath execNm ++ findExec PS_CMD /usr/bin/ps ps ++ Nm=PS_CMD ++ confPath=/usr/bin/ps ++ execNm=ps ++ eval PS_CMD=/usr/bin/ps +++ PS_CMD=/usr/bin/ps ++ '[' '!' -x /usr/bin/ps ']' ++ unset Nm confPath execNm ++ findExec EXPR_CMD /usr/bin/expr expr ++ Nm=EXPR_CMD ++ confPath=/usr/bin/expr ++ execNm=expr ++ eval EXPR_CMD=/usr/bin/expr +++ EXPR_CMD=/usr/bin/expr ++ '[' '!' -x /usr/bin/expr ']' ++ unset Nm confPath execNm ++ findExec BASENAME_CMD /usr/bin/basename basename ++ Nm=BASENAME_CMD ++ confPath=/usr/bin/basename ++ execNm=basename ++ eval BASENAME_CMD=/usr/bin/basename +++ BASENAME_CMD=/usr/bin/basename ++ '[' '!' -x /usr/bin/basename ']' ++ unset Nm confPath execNm ++ unset -f findExec ++ '[' -f /proc/29603/exe ']' +++ /usr/bin/readlink /proc/29603/exe ++ my_shell=/usr/bin/bash +++ /usr/bin/expr /usr/bin/bash : '-*\(.*\)' ++ my_shell=/usr/bin/bash +++ /usr/bin/basename /usr/bin/bash ++ my_shell=bash ++ case ${my_shell} in ++ '[' -f /usr/share/lmod/lmod/init/bash ']' ++ . /usr/share/lmod/lmod/init/bash +++ '[' -z '' ']' +++ case "$-" in +++ __lmod_vx=x +++ '[' -n x ']' +++ set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for this output (/usr/share/lmod/lmod/init/bash) Shell debugging restarted +++ unset __lmod_vx ++ unset my_shell PS_CMD EXPR_CMD BASENAME_CMD MODULEPATH_INIT LMOD_ALLOW_ROOT_USE READLINK_CMD + module load mpi/openmpi-ppc64le + local __lmod_my_status + local __lmod_sh_dbg + '[' -z '' ']' + case "$-" in + __lmod_sh_dbg=x + '[' -n x ']' + set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for Lmod's output Shell debugging restarted + return 0 + export PRTE_MCA_rmaps_default_mapping_policy=:oversubscribe + PRTE_MCA_rmaps_default_mapping_policy=:oversubscribe + mkdir -p /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le//usr/lib64/openmpi/bin + install -p -m 755 elk_openmpi /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le//usr/lib64/openmpi/bin/elk_binary_openmpi + echo '#!/bin/bash' + echo 'export FLEXIBLAS=openblas-serial' + echo -n 'elk_binary_openmpi ' + echo '"$@"' + chmod 755 /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le//usr/lib64/openmpi/bin/elk_openmpi + cat /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le//usr/lib64/openmpi/bin/elk_openmpi #!/bin/bash export FLEXIBLAS=openblas-serial elk_binary_openmpi "$@" + . /etc/profile.d/modules.sh ++ . /etc/profile.d/00-modulepath.sh +++ '[' -z /etc/modulefiles:/usr/share/modulefiles:/usr/share/modulefiles/Linux:/usr/share/modulefiles/Core:/usr/share/lmod/lmod/modulefiles/Core ']' +++ : ++ '[' -z '' ']' ++ LMOD_ALLOW_ROOT_USE=yes ++ '[' -n '' ']' ++ '[' yes '!=' yes ']' ++ '[' -z /usr/share/modulefiles ']' ++ findExec READLINK_CMD /usr/bin/readlink readlink ++ Nm=READLINK_CMD ++ confPath=/usr/bin/readlink ++ execNm=readlink ++ eval READLINK_CMD=/usr/bin/readlink +++ READLINK_CMD=/usr/bin/readlink ++ '[' '!' -x /usr/bin/readlink ']' ++ unset Nm confPath execNm ++ findExec PS_CMD /usr/bin/ps ps ++ Nm=PS_CMD ++ confPath=/usr/bin/ps ++ execNm=ps ++ eval PS_CMD=/usr/bin/ps +++ PS_CMD=/usr/bin/ps ++ '[' '!' -x /usr/bin/ps ']' ++ unset Nm confPath execNm ++ findExec EXPR_CMD /usr/bin/expr expr ++ Nm=EXPR_CMD ++ confPath=/usr/bin/expr ++ execNm=expr ++ eval EXPR_CMD=/usr/bin/expr +++ EXPR_CMD=/usr/bin/expr ++ '[' '!' -x /usr/bin/expr ']' ++ unset Nm confPath execNm ++ findExec BASENAME_CMD /usr/bin/basename basename ++ Nm=BASENAME_CMD ++ confPath=/usr/bin/basename ++ execNm=basename ++ eval BASENAME_CMD=/usr/bin/basename +++ BASENAME_CMD=/usr/bin/basename ++ '[' '!' -x /usr/bin/basename ']' ++ unset Nm confPath execNm ++ unset -f findExec ++ '[' -f /proc/29603/exe ']' +++ /usr/bin/readlink /proc/29603/exe ++ my_shell=/usr/bin/bash +++ /usr/bin/expr /usr/bin/bash : '-*\(.*\)' ++ my_shell=/usr/bin/bash +++ /usr/bin/basename /usr/bin/bash ++ my_shell=bash ++ case ${my_shell} in ++ '[' -f /usr/share/lmod/lmod/init/bash ']' ++ . /usr/share/lmod/lmod/init/bash +++ '[' -z '' ']' +++ case "$-" in +++ __lmod_vx=x +++ '[' -n x ']' +++ set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for this output (/usr/share/lmod/lmod/init/bash) Shell debugging restarted +++ unset __lmod_vx ++ unset my_shell PS_CMD EXPR_CMD BASENAME_CMD MODULEPATH_INIT LMOD_ALLOW_ROOT_USE READLINK_CMD + module unload mpi/openmpi-ppc64le + local __lmod_my_status + local __lmod_sh_dbg + '[' -z '' ']' + case "$-" in + __lmod_sh_dbg=x + '[' -n x ']' + set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for Lmod's output Shell debugging restarted + return 0 + . /etc/profile.d/modules.sh ++ . /etc/profile.d/00-modulepath.sh +++ '[' -z /etc/modulefiles:/usr/share/modulefiles:/usr/share/modulefiles/Linux:/usr/share/modulefiles/Core:/usr/share/lmod/lmod/modulefiles/Core ']' +++ : ++ '[' -z '' ']' ++ LMOD_ALLOW_ROOT_USE=yes ++ '[' -n '' ']' ++ '[' yes '!=' yes ']' ++ '[' -z /usr/share/modulefiles ']' ++ findExec READLINK_CMD /usr/bin/readlink readlink ++ Nm=READLINK_CMD ++ confPath=/usr/bin/readlink ++ execNm=readlink ++ eval READLINK_CMD=/usr/bin/readlink +++ READLINK_CMD=/usr/bin/readlink ++ '[' '!' -x /usr/bin/readlink ']' ++ unset Nm confPath execNm ++ findExec PS_CMD /usr/bin/ps ps ++ Nm=PS_CMD ++ confPath=/usr/bin/ps ++ execNm=ps ++ eval PS_CMD=/usr/bin/ps +++ PS_CMD=/usr/bin/ps ++ '[' '!' -x /usr/bin/ps ']' ++ unset Nm confPath execNm ++ findExec EXPR_CMD /usr/bin/expr expr ++ Nm=EXPR_CMD ++ confPath=/usr/bin/expr ++ execNm=expr ++ eval EXPR_CMD=/usr/bin/expr +++ EXPR_CMD=/usr/bin/expr ++ '[' '!' -x /usr/bin/expr ']' ++ unset Nm confPath execNm ++ findExec BASENAME_CMD /usr/bin/basename basename ++ Nm=BASENAME_CMD ++ confPath=/usr/bin/basename ++ execNm=basename ++ eval BASENAME_CMD=/usr/bin/basename +++ BASENAME_CMD=/usr/bin/basename ++ '[' '!' -x /usr/bin/basename ']' ++ unset Nm confPath execNm ++ unset -f findExec ++ '[' -f /proc/29603/exe ']' +++ /usr/bin/readlink /proc/29603/exe ++ my_shell=/usr/bin/bash +++ /usr/bin/expr /usr/bin/bash : '-*\(.*\)' ++ my_shell=/usr/bin/bash +++ /usr/bin/basename /usr/bin/bash ++ my_shell=bash ++ case ${my_shell} in ++ '[' -f /usr/share/lmod/lmod/init/bash ']' ++ . /usr/share/lmod/lmod/init/bash +++ '[' -z '' ']' +++ case "$-" in +++ __lmod_vx=x +++ '[' -n x ']' +++ set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for this output (/usr/share/lmod/lmod/init/bash) Shell debugging restarted +++ unset __lmod_vx ++ unset my_shell PS_CMD EXPR_CMD BASENAME_CMD MODULEPATH_INIT LMOD_ALLOW_ROOT_USE READLINK_CMD + module load mpi/mpich-ppc64le + local __lmod_my_status + local __lmod_sh_dbg + '[' -z '' ']' + case "$-" in + __lmod_sh_dbg=x + '[' -n x ']' + set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for Lmod's output Shell debugging restarted + return 0 + export 'CFLAGS=-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + CFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + mkdir -p /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le//usr/lib64/mpich/bin + install -p -m 755 elk_mpich /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le//usr/lib64/mpich/bin/elk_binary_mpich + echo '#!/bin/bash' + echo 'export FLEXIBLAS=openblas-serial' + echo -n 'elk_binary_mpich ' + echo '"$@"' + chmod 755 /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le//usr/lib64/mpich/bin/elk_mpich + cat /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le//usr/lib64/mpich/bin/elk_mpich #!/bin/bash export FLEXIBLAS=openblas-serial elk_binary_mpich "$@" + . /etc/profile.d/modules.sh ++ . /etc/profile.d/00-modulepath.sh +++ '[' -z /etc/modulefiles:/usr/share/modulefiles:/usr/share/modulefiles/Linux:/usr/share/modulefiles/Core:/usr/share/lmod/lmod/modulefiles/Core ']' +++ : ++ '[' -z '' ']' ++ LMOD_ALLOW_ROOT_USE=yes ++ '[' -n '' ']' ++ '[' yes '!=' yes ']' ++ '[' -z /usr/share/modulefiles ']' ++ findExec READLINK_CMD /usr/bin/readlink readlink ++ Nm=READLINK_CMD ++ confPath=/usr/bin/readlink ++ execNm=readlink ++ eval READLINK_CMD=/usr/bin/readlink +++ READLINK_CMD=/usr/bin/readlink ++ '[' '!' -x /usr/bin/readlink ']' ++ unset Nm confPath execNm ++ findExec PS_CMD /usr/bin/ps ps ++ Nm=PS_CMD ++ confPath=/usr/bin/ps ++ execNm=ps ++ eval PS_CMD=/usr/bin/ps +++ PS_CMD=/usr/bin/ps ++ '[' '!' -x /usr/bin/ps ']' ++ unset Nm confPath execNm ++ findExec EXPR_CMD /usr/bin/expr expr ++ Nm=EXPR_CMD ++ confPath=/usr/bin/expr ++ execNm=expr ++ eval EXPR_CMD=/usr/bin/expr +++ EXPR_CMD=/usr/bin/expr ++ '[' '!' -x /usr/bin/expr ']' ++ unset Nm confPath execNm ++ findExec BASENAME_CMD /usr/bin/basename basename ++ Nm=BASENAME_CMD ++ confPath=/usr/bin/basename ++ execNm=basename ++ eval BASENAME_CMD=/usr/bin/basename +++ BASENAME_CMD=/usr/bin/basename ++ '[' '!' -x /usr/bin/basename ']' ++ unset Nm confPath execNm ++ unset -f findExec ++ '[' -f /proc/29603/exe ']' +++ /usr/bin/readlink /proc/29603/exe ++ my_shell=/usr/bin/bash +++ /usr/bin/expr /usr/bin/bash : '-*\(.*\)' ++ my_shell=/usr/bin/bash +++ /usr/bin/basename /usr/bin/bash ++ my_shell=bash ++ case ${my_shell} in ++ '[' -f /usr/share/lmod/lmod/init/bash ']' ++ . /usr/share/lmod/lmod/init/bash +++ '[' -z '' ']' +++ case "$-" in +++ __lmod_vx=x +++ '[' -n x ']' +++ set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for this output (/usr/share/lmod/lmod/init/bash) Shell debugging restarted +++ unset __lmod_vx ++ unset my_shell PS_CMD EXPR_CMD BASENAME_CMD MODULEPATH_INIT LMOD_ALLOW_ROOT_USE READLINK_CMD + module unload mpi/mpich-ppc64le + local __lmod_my_status + local __lmod_sh_dbg + '[' -z '' ']' + case "$-" in + __lmod_sh_dbg=x + '[' -n x ']' + set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for Lmod's output Shell debugging restarted + return 0 + mkdir -p /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/share/elk + cp -rp species /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/share/elk + cp -rp make.inc make.inc.common make.inc_mpich make.inc_openmp make.inc_openmpi /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/share/elk + cp -rp tests tests-libxc examples /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/share/elk + /usr/bin/find-debuginfo -j2 --strict-build-id -m -i --build-id-seed 8.3.22-1.fc37 --unique-debug-suffix -8.3.22-1.fc37.ppc64le --unique-debug-src-base elk-8.3.22-1.fc37.ppc64le --run-dwz --dwz-low-mem-die-limit 10000000 --dwz-max-die-limit 50000000 -S debugsourcefiles.list /builddir/build/BUILD/elk-8.3.22 extracting debug info from /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/bin/elk-eos extracting debug info from /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/bin/elk extracting debug info from /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/bin/elk-spacegroup extracting debug info from /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/lib64/mpich/bin/elk_binary_mpich extracting debug info from /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/lib64/openmpi/bin/elk_binary_openmpi original debug info size: 14848kB, size after compression: 13504kB /usr/bin/sepdebugcrcfix: Updated 5 CRC32s, 0 CRC32s did match. 4254 blocks + /usr/lib/rpm/check-buildroot + /usr/lib/rpm/redhat/brp-ldconfig + /usr/lib/rpm/brp-compress + /usr/lib/rpm/redhat/brp-strip-lto /usr/bin/strip + /usr/lib/rpm/brp-strip-static-archive /usr/bin/strip + /usr/lib/rpm/check-rpaths + /usr/lib/rpm/redhat/brp-mangle-shebangs mangling shebang in /usr/share/elk/tests-libxc/test.sh from /bin/sh to #!/usr/bin/sh mangling shebang in /usr/share/elk/tests/test-mpi.sh from /bin/sh to #!/usr/bin/sh mangling shebang in /usr/share/elk/tests/test.sh from /bin/sh to #!/usr/bin/sh mangling shebang in /usr/share/elk/tests/test from /bin/sh to #!/usr/bin/sh mangling shebang in /usr/lib64/mpich/bin/elk_mpich from /bin/bash to #!/usr/bin/bash mangling shebang in /usr/lib64/openmpi/bin/elk_openmpi from /bin/bash to #!/usr/bin/bash + /usr/lib/rpm/redhat/brp-python-bytecompile '' 1 0 + /usr/lib/rpm/redhat/brp-python-hardlink Executing(%check): /bin/sh -e /var/tmp/rpm-tmp.pg7C12 + umask 022 + cd /builddir/build/BUILD + CFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + export CFLAGS + CXXFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + export CXXFLAGS + FFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -I/usr/lib64/gfortran/modules' + export FFLAGS + FCFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -I/usr/lib64/gfortran/modules' + export FCFLAGS + LDFLAGS='-Wl,-z,relro -Wl,--as-needed -Wl,-z,now -specs=/usr/lib/rpm/redhat/redhat-hardened-ld -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -Wl,--build-id=sha1 -Wl,-dT,/builddir/build/BUILD/elk-8.3.22/.package_note-elk-8.3.22-1.fc37.ppc64le.ld' + export LDFLAGS + LT_SYS_LIBRARY_PATH=/usr/lib64: + export LT_SYS_LIBRARY_PATH + CC=gcc + export CC + CXX=g++ + export CXX + '[' -f /usr/lib/rpm/generate-rpm-note.sh ']' + /usr/lib/rpm/generate-rpm-note.sh elk 8.3.22-1.fc37 ppc64le + cd elk-8.3.22 + export NPROC=1 + NPROC=1 + export OMP_NUM_THREADS=1 + OMP_NUM_THREADS=1 + mv tests-libxc tests-libxc.orig + mv tests tests.orig + ELK_EXECUTABLE=../../elk + MPI_SUFFIX=_openmp + cp -rp tests-libxc.orig tests-libxc + sed -i s#../../src/elk#../../elk#g tests-libxc/test.sh + sed -i '/Failed/ a cat test.log' tests-libxc/test.sh + /usr/bin/make test-libxc + tee test-libxc.1_openmp.log cd tests-libxc; ./test.sh Running test in directory test_001... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.4000 to 2.2888 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.4000 to 2.2888 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 343 The leading minor of the overlap matrix of order 158 is not positive definite Order of overlap matrix : 185 Running test in directory test_002... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff7c5e6873 in ??? #1 0x7fff7c5e7f43 in ??? #2 0x7fff7c5e99eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.3297 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.888799720 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 26.31722817 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.675514108 -4.590500000 for s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 26.90539645 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 19.67744218 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.608854139 -4.590500000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 28.22815464 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 19.76954364 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 21.76167544 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 19.56599869 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 19.51178810 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 19.30934703 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 19.83838343 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 18.60616034 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 18.07718093 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 20.15227982 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 19.05584795 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 19.74900171 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 19.90349151 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.788147218 -4.590500000 for s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 18.52223208 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.864038521 -4.590500000 for s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 18.93693427 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 19.07545342 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 18.80138149 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.719680984 -4.590500000 for s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 18.78888773 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 19.28803600 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 19.78389480 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 19.79090728 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 25 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.643378168 -4.590500000 for s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 19.77455103 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 26 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.774079480 -4.590500000 for s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 20.43755373 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 20.10819102 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 20.02303976 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 19.74326205 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 20.31984123 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 20.14268298 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 20.29930630 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 20.30201963 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 19.44912760 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 21.16938539 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 21.00380204 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 21.15800990 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 21.06324131 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 20.77461000 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 20.75863026 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 20.34089506 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 20.15370152 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 19.94100645 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 19.92330869 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 19.89751473 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 20.04629506 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 20.21110403 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 20.23241680 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 20.22861681 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 20.14149648 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 20.08420146 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 20.13710843 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 20.01296898 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 19.94691539 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 19.84002367 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 19.86561148 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 19.81241050 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 20.02597218 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 20.34494254 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 19.99978325 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 20.08505488 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 20.16277069 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 20.04038491 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 20.00361097 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 20.28357420 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 20.15090689 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 20.25718776 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 20.32039271 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 20.31109398 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 20.07885786 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 19.99270944 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 20.02685756 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 19.83145620 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 19.48376699 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 19.78362894 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 20.13395669 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 20.28966070 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 20.32311109 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 20.29684014 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 20.18042816 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 19.83158820 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 20.64064016 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 19.18112897 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 20.10421488 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 20.22445965 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 20.29351032 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 20.22876567 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 20.30983061 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 20.33790279 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 20.32368949 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 19.72861204 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 20.50543939 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 20.44409267 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 19.52530577 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 20.13868623 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 20.59713566 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 20.38608739 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 20.24463625 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 20.17172321 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 20.23208383 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 20.17399291 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 20.11842263 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 20.37115417 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 20.40433160 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 20.33230188 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 20.46620631 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 20.43918598 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 20.26664606 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 20.40851356 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 20.63344129 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 20.49973113 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 20.36201466 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 20.73342849 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 20.61456730 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 20.01875066 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 20.42798207 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 20.43358055 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 20.03840943 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 20.02326194 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 20.06108676 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 20.36974990 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 19.84113510 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 20.39249819 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 20.64627443 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 20.44555198 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 20.55113552 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 20.53392414 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 20.58661998 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 20.45211161 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 19.41690279 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 20.29816399 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 20.34364224 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 20.24482234 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 20.33464698 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 20.46659401 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 20.21198567 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 19.89137348 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 20.56919182 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 20.47829496 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 20.53111815 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 20.53241538 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 20.54632884 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 19.78781183 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 20.22299163 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 20.62948433 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 19.37667474 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 20.08193422 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 20.54162024 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 20.31027902 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 20.43646242 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 20.30281080 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 20.39274446 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 20.46323800 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 20.50603588 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 20.60958640 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 20.65268452 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 19.99024811 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 20.25151883 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 20.38773413 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 20.13846655 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 20.66465568 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 20.54625963 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 20.26298974 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 20.29071115 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 20.31533993 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 20.47480637 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 20.36531664 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 20.52865943 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 20.44565817 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 20.45784517 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 19.72050588 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 20.02543346 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 19.81848296 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 19.64424716 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 19.06077695 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 20.65948762 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 20.52380077 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 20.04103324 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 20.64777417 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 20.16044516 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 20.42804605 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 20.64427191 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 20.13705154 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 19.76158190 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 19.93571789 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 20.38742608 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 20.62729142 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 20.38771197 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 20.43275661 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 20.43873627 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 20.49814006 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 20.59959015 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 20.42937850 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 20.44829888 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 20.24532031 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 20.47002753 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 20.58835892 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 20.59498252 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 20.58111867 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 20.49537681 Required : 28.00000000 Info(elk): current task : 330 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Info(tddftsplr): 1 of 1000 k-points Info(tddftsplr): 751 of 1000 k-points Info(tddftsplr): 626 of 1000 k-points Info(tddftsplr): 501 of 1000 k-points Info(tddftsplr): 126 of 1000 k-points Info(tddftsplr): 376 of 1000 k-points Info(tddftsplr): 251 of 1000 k-points Info(tddftsplr): 876 of 1000 k-points Info(tddftsplr): 2 of 1000 k-points Info(tddftsplr): 502 of 1000 k-points Info(tddftsplr): 627 of 1000 k-points Info(tddftsplr): 252 of 1000 k-points Info(tddftsplr): 752 of 1000 k-points Info(tddftsplr): 377 of 1000 k-points Info(tddftsplr): 127 of 1000 k-points Info(tddftsplr): 877 of 1000 k-points Info(tddftsplr): 3 of 1000 k-points Info(tddftsplr): 628 of 1000 k-points Info(tddftsplr): 253 of 1000 k-points Info(tddftsplr): 878 of 1000 k-points Info(tddftsplr): 503 of 1000 k-points Info(tddftsplr): 378 of 1000 k-points Info(tddftsplr): 128 of 1000 k-points Info(tddftsplr): 753 of 1000 k-points Info(tddftsplr): 4 of 1000 k-points Info(tddftsplr): 629 of 1000 k-points Info(tddftsplr): 254 of 1000 k-points Info(tddftsplr): 129 of 1000 k-points Info(tddftsplr): 754 of 1000 k-points Info(tddftsplr): 504 of 1000 k-points Info(tddftsplr): 379 of 1000 k-points Info(tddftsplr): 879 of 1000 k-points Info(tddftsplr): 5 of 1000 k-points Info(tddftsplr): 630 of 1000 k-points Info(tddftsplr): 255 of 1000 k-points Info(tddftsplr): 755 of 1000 k-points Info(tddftsplr): 880 of 1000 k-points Info(tddftsplr): 380 of 1000 k-points Info(tddftsplr): 130 of 1000 k-points Info(tddftsplr): 505 of 1000 k-points Info(tddftsplr): 6 of 1000 k-points Info(tddftsplr): 631 of 1000 k-points Info(tddftsplr): 756 of 1000 k-points Info(tddftsplr): 881 of 1000 k-points Info(tddftsplr): 256 of 1000 k-points Info(tddftsplr): 131 of 1000 k-points Info(tddftsplr): 381 of 1000 k-points Info(tddftsplr): 506 of 1000 k-points Info(tddftsplr): 7 of 1000 k-points Info(tddftsplr): 257 of 1000 k-points Info(tddftsplr): 757 of 1000 k-points Info(tddftsplr): 632 of 1000 k-points Info(tddftsplr): 132 of 1000 k-points Info(tddftsplr): 882 of 1000 k-points Info(tddftsplr): 507 of 1000 k-points Info(tddftsplr): 382 of 1000 k-points Info(tddftsplr): 8 of 1000 k-points Info(tddftsplr): 633 of 1000 k-points Info(tddftsplr): 258 of 1000 k-points Info(tddftsplr): 758 of 1000 k-points Info(tddftsplr): 508 of 1000 k-points Info(tddftsplr): 133 of 1000 k-points Info(tddftsplr): 883 of 1000 k-points Info(tddftsplr): 383 of 1000 k-points Info(tddftsplr): 759 of 1000 k-points Info(tddftsplr): 9 of 1000 k-points Info(tddftsplr): 634 of 1000 k-points Info(tddftsplr): 259 of 1000 k-points Info(tddftsplr): 134 of 1000 k-points Info(tddftsplr): 509 of 1000 k-points Info(tddftsplr): 884 of 1000 k-points Info(tddftsplr): 384 of 1000 k-points Info(tddftsplr): 10 of 1000 k-points Info(tddftsplr): 635 of 1000 k-points Info(tddftsplr): 510 of 1000 k-points Info(tddftsplr): 760 of 1000 k-points Info(tddftsplr): 135 of 1000 k-points Info(tddftsplr): 260 of 1000 k-points Info(tddftsplr): 885 of 1000 k-points Info(tddftsplr): 385 of 1000 k-points Info(tddftsplr): 511 of 1000 k-points Info(tddftsplr): 11 of 1000 k-points Info(tddftsplr): 636 of 1000 k-points Info(tddftsplr): 261 of 1000 k-points Info(tddftsplr): 761 of 1000 k-points Info(tddftsplr): 136 of 1000 k-points Info(tddftsplr): 886 of 1000 k-points Info(tddftsplr): 512 of 1000 k-points Info(tddftsplr): 637 of 1000 k-points Info(tddftsplr): 12 of 1000 k-points Info(tddftsplr): 386 of 1000 k-points Info(tddftsplr): 262 of 1000 k-points Info(tddftsplr): 887 of 1000 k-points Info(tddftsplr): 762 of 1000 k-points Info(tddftsplr): 137 of 1000 k-points Info(tddftsplr): 513 of 1000 k-points 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Info(tddftsplr): 493 of 1000 k-points Info(tddftsplr): 118 of 1000 k-points Info(tddftsplr): 993 of 1000 k-points Info(tddftsplr): 868 of 1000 k-points Info(tddftsplr): 367 of 1000 k-points Info(tddftsplr): 619 of 1000 k-points Info(tddftsplr): 241 of 1000 k-points Info(tddftsplr): 743 of 1000 k-points Info(tddftsplr): 494 of 1000 k-points Info(tddftsplr): 994 of 1000 k-points Info(tddftsplr): 242 of 1000 k-points Info(tddftsplr): 119 of 1000 k-points Info(tddftsplr): 368 of 1000 k-points Info(tddftsplr): 869 of 1000 k-points Info(tddftsplr): 620 of 1000 k-points Info(tddftsplr): 744 of 1000 k-points Info(tddftsplr): 495 of 1000 k-points Info(tddftsplr): 995 of 1000 k-points Info(tddftsplr): 870 of 1000 k-points Info(tddftsplr): 243 of 1000 k-points Info(tddftsplr): 120 of 1000 k-points Info(tddftsplr): 369 of 1000 k-points Info(tddftsplr): 621 of 1000 k-points Info(tddftsplr): 745 of 1000 k-points Info(tddftsplr): 871 of 1000 k-points Info(tddftsplr): 496 of 1000 k-points Info(tddftsplr): 996 of 1000 k-points Info(tddftsplr): 121 of 1000 k-points Info(tddftsplr): 370 of 1000 k-points Info(tddftsplr): 244 of 1000 k-points Info(tddftsplr): 622 of 1000 k-points Info(tddftsplr): 497 of 1000 k-points Info(tddftsplr): 872 of 1000 k-points Info(tddftsplr): 997 of 1000 k-points Info(tddftsplr): 371 of 1000 k-points Info(tddftsplr): 746 of 1000 k-points Info(tddftsplr): 245 of 1000 k-points Info(tddftsplr): 623 of 1000 k-points Info(tddftsplr): 122 of 1000 k-points Info(tddftsplr): 498 of 1000 k-points Info(tddftsplr): 873 of 1000 k-points Info(tddftsplr): 372 of 1000 k-points Info(tddftsplr): 998 of 1000 k-points Info(tddftsplr): 747 of 1000 k-points Info(tddftsplr): 123 of 1000 k-points Info(tddftsplr): 246 of 1000 k-points Info(tddftsplr): 624 of 1000 k-points Info(tddftsplr): 499 of 1000 k-points Info(tddftsplr): 874 of 1000 k-points Info(tddftsplr): 999 of 1000 k-points Info(tddftsplr): 247 of 1000 k-points Info(tddftsplr): 124 of 1000 k-points Info(tddftsplr): 373 of 1000 k-points Info(tddftsplr): 625 of 1000 k-points Info(tddftsplr): 748 of 1000 k-points Info(tddftsplr): 875 of 1000 k-points Info(tddftsplr): 500 of 1000 k-points Info(tddftsplr): 1000 of 1000 k-points Info(tddftsplr): 125 of 1000 k-points Info(tddftsplr): 248 of 1000 k-points Info(tddftsplr): 374 of 1000 k-points Info(tddftsplr): 749 of 1000 k-points Info(tddftsplr): 375 of 1000 k-points Info(tddftsplr): 750 of 1000 k-points Info(tddftsplr): 249 of 1000 k-points Info(tddftsplr): 250 of 1000 k-points Info(tddftsplr): Spin-dependent response function chi_ij(G,G',q,w) written to CHI_ij.OUT for i,j = 0-3; G = G' = 0; and all wplot frequencies q-vector (lattice coordinates) : 0.1000000000 0.3000000000 0.000000000 q-vector length : 0.4621801190 The elements of chi labeled by (i,j) form the 4x4 matrix : (_|_ _ _) chi(G,G',q,w) = ( | ) ( | ) ( | ) (0,0) is the charge-charge response drho/dv (0,1-3) is the charge-magnetisation response drho/dB (1-3,0) is the magnetisation-charge response dm/v (1-3,1-3) is the magnetisation-magnetisation response dm/dB Non-interacting Kohn-Sham reponse function written to CHI0_ij.OUT Transverse components corresponding to m_+- = m_x +- im_y written to CHI_T.OUT and CHI0_T.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1517.12685504 TEST_000.OUT : -1466.13404643 absolute difference : 50.9928086100 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.151712685504E-01 Running test in directory test_003... Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Backtrace for this error: Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.2310 Info(checkmt): reduced muffin-tin radius of species 2 (Co) from 2.4000 to 2.2310 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 208 The leading minor of the overlap matrix of order 89 is not positive definite Order of overlap matrix : 119 Running test in directory test_004... ERROR STOP Error termination. Backtrace: #0 0x7fff9a116873 in ??? #1 0x7fff9a117f43 in ??? #2 0x7fff9a1199eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.24661092 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.24999501 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.41698933 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.51176029 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.54006153 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.54593224 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.54703537 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.54712565 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.54741584 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.54752245 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 25.54757106 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 25.54754839 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 25.54753970 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 25.54753980 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 25.54753997 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 25.54753999 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 25.54753999 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 25.54754001 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 25.54754000 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 25.54754000 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 25.54754000 Required : 28.00000000 Info(elk): current task : 120 Info(genpmat): 5 of 29 k-points Info(genpmat): 1 of 29 k-points Info(genpmat): 9 of 29 k-points Info(genpmat): 13 of 29 k-points Info(genpmat): 17 of 29 k-points Info(genpmat): 21 of 29 k-points Info(genpmat): 24 of 29 k-points Info(genpmat): 27 of 29 k-points Info(genpmat): 2 of 29 k-points Info(genpmat): 14 of 29 k-points Info(genpmat): 6 of 29 k-points Info(genpmat): 28 of 29 k-points Info(genpmat): 22 of 29 k-points Info(genpmat): 25 of 29 k-points Info(genpmat): 10 of 29 k-points Info(genpmat): 18 of 29 k-points Info(genpmat): 3 of 29 k-points Info(genpmat): 15 of 29 k-points Info(genpmat): 11 of 29 k-points Info(genpmat): 29 of 29 k-points Info(genpmat): 7 of 29 k-points Info(genpmat): 23 of 29 k-points Info(genpmat): 26 of 29 k-points Info(genpmat): 19 of 29 k-points Info(genpmat): 4 of 29 k-points Info(genpmat): 16 of 29 k-points Info(genpmat): 12 of 29 k-points Info(genpmat): 8 of 29 k-points Info(genpmat): 20 of 29 k-points Info(writepmat): momentum matrix elements written to file PMAT.OUT Info(elk): current task : 121 Info(dielectric): dielectric tensor written to EPSILON_ij.OUT optical conductivity written to SIGMA_ij.OUT for components i = 1, j = 1 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -538.189221047 TEST_000.OUT : -538.561900090 absolute difference : 0.372679043000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.538189221047E-02 Running test in directory test_005... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff8d196873 in ??? #1 0x7fff8d197f43 in ??? #2 0x7fff8d1999eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 3 (Cu) from 2.4000 to 1.9694 Info(checkmt): reduced muffin-tin radius of species 4 (O) from 1.8000 to 1.4770 Info(findsymcrys): atomic basis shift (lattice) : -0.5000000000 -0.5000000000 -0.5000000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 330.2427476 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 343.3900266 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 336.6398879 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 375.5905878 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 360.3313653 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 343.5965897 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 984.0569132 Required : 294.0000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 18898.96103 Required : 294.0000000 Warning(linengy): could not find 13 linearisation energies in s.c. loop 9 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -38.54515699 -5.251500000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 128.0105027 Required : 294.0000000 Warning(gndstate): failed to reach self-consistency after 10 loops Warning(linengy): could not find 13 linearisation energies in s.c. loop 10 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -20.70463044 -5.251500000 for s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 128.0137926 Required : 294.0000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -25129.0485518 TEST_000.OUT : -32237.8766147 absolute difference : 7108.82806290 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.251290485518 Running test in directory test_006... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff873d6873 in ??? #1 0x7fff873d7f43 in ??? #2 0x7fff873d99eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.80006961 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.79778549 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.73540958 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.67918507 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.63646831 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.61683291 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.60946757 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.60947800 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.60950470 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.60950671 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 25.60950524 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 25.60950412 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 25.60950320 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 25.60950327 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 25.60950333 Required : 28.00000000 Info(elk): current task : 5 Info(genkmat): 5 of 16 k-points Info(genkmat): 1 of 16 k-points Info(genkmat): 3 of 16 k-points Info(genkmat): 7 of 16 k-points Info(genkmat): 9 of 16 k-points Info(genkmat): 11 of 16 k-points Info(genkmat): 13 of 16 k-points Info(genkmat): 15 of 16 k-points Info(genkmat): 2 of 16 k-points Info(genkmat): 4 of 16 k-points Info(genkmat): 6 of 16 k-points Info(genkmat): 16 of 16 k-points Info(genkmat): 8 of 16 k-points Info(genkmat): 14 of 16 k-points Info(genkmat): 12 of 16 k-points Info(genkmat): 10 of 16 k-points Info(hartfock): self-consistent loop number : 1 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.73681019 Required : 28.00000000 Info(hartfock): self-consistent loop number : 2 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.31647974 Required : 28.00000000 Info(hartfock): self-consistent loop number : 3 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -2.275758113 -2.000000000 for s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.23296926 Required : 28.00000000 Info(hartfock): self-consistent loop number : 4 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.43788821 Required : 28.00000000 Info(hartfock): self-consistent loop number : 5 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.37454414 Required : 28.00000000 Info(hartfock): self-consistent loop number : 6 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.32152307 Required : 28.00000000 Info(hartfock): self-consistent loop number : 7 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.28909597 Required : 28.00000000 Info(hartfock): self-consistent loop number : 8 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.11542087 Required : 28.00000000 Info(hartfock): self-consistent loop number : 9 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.21374946 Required : 28.00000000 Info(hartfock): self-consistent loop number : 10 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.28013976 Required : 28.00000000 Info(hartfock): self-consistent loop number : 11 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 25.32871799 Required : 28.00000000 Info(hartfock): self-consistent loop number : 12 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 25.27534753 Required : 28.00000000 Info(hartfock): self-consistent loop number : 13 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 25.24297551 Required : 28.00000000 Info(hartfock): self-consistent loop number : 14 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 25.20529987 Required : 28.00000000 Info(hartfock): self-consistent loop number : 15 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 25.45076916 Required : 28.00000000 Info(hartfock): self-consistent loop number : 16 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 25.05535025 Required : 28.00000000 Info(hartfock): self-consistent loop number : 17 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 25.34181637 Required : 28.00000000 Info(hartfock): self-consistent loop number : 18 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 25.39562753 Required : 28.00000000 Info(hartfock): self-consistent loop number : 19 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 25.21423786 Required : 28.00000000 Info(hartfock): self-consistent loop number : 20 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 25.43172296 Required : 28.00000000 Info(hartfock): self-consistent loop number : 21 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 25.32450037 Required : 28.00000000 Info(hartfock): self-consistent loop number : 22 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 25.26436096 Required : 28.00000000 Info(hartfock): self-consistent loop number : 23 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 25.19117297 Required : 28.00000000 Info(hartfock): self-consistent loop number : 24 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 25.48505468 Required : 28.00000000 Info(hartfock): self-consistent loop number : 25 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 25.33806775 Required : 28.00000000 Info(hartfock): self-consistent loop number : 26 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 25.18432691 Required : 28.00000000 Info(hartfock): self-consistent loop number : 27 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 25.12911667 Required : 28.00000000 Info(hartfock): self-consistent loop number : 28 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 25.17375485 Required : 28.00000000 Info(hartfock): self-consistent loop number : 29 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 25.33675393 Required : 28.00000000 Info(hartfock): self-consistent loop number : 30 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 25.32371388 Required : 28.00000000 Info(hartfock): self-consistent loop number : 31 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 25.35746658 Required : 28.00000000 Info(hartfock): self-consistent loop number : 32 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 25.40157008 Required : 28.00000000 Info(hartfock): self-consistent loop number : 33 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 25.33526323 Required : 28.00000000 Info(hartfock): self-consistent loop number : 34 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 25.41630863 Required : 28.00000000 Info(hartfock): self-consistent loop number : 35 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 25.31860060 Required : 28.00000000 Info(hartfock): self-consistent loop number : 36 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 25.17706694 Required : 28.00000000 Info(hartfock): self-consistent loop number : 37 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 25.23559258 Required : 28.00000000 Info(hartfock): self-consistent loop number : 38 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 25.16713812 Required : 28.00000000 Info(hartfock): self-consistent loop number : 39 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 25.07443331 Required : 28.00000000 Info(hartfock): self-consistent loop number : 40 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 25.39882671 Required : 28.00000000 Info(hartfock): self-consistent loop number : 41 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 25.26627623 Required : 28.00000000 Info(hartfock): self-consistent loop number : 42 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 25.34732725 Required : 28.00000000 Info(hartfock): self-consistent loop number : 43 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 25.22684877 Required : 28.00000000 Info(hartfock): self-consistent loop number : 44 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 25.22968274 Required : 28.00000000 Info(hartfock): self-consistent loop number : 45 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 25.23261075 Required : 28.00000000 Info(hartfock): self-consistent loop number : 46 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 25.17062427 Required : 28.00000000 Info(hartfock): self-consistent loop number : 47 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 25.38792213 Required : 28.00000000 Info(hartfock): self-consistent loop number : 48 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 25.31344724 Required : 28.00000000 Info(hartfock): self-consistent loop number : 49 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 25.10091729 Required : 28.00000000 Info(hartfock): self-consistent loop number : 50 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 25.46147808 Required : 28.00000000 Info(hartfock): self-consistent loop number : 51 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 25.19583989 Required : 28.00000000 Info(hartfock): self-consistent loop number : 52 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 25.34289321 Required : 28.00000000 Info(hartfock): self-consistent loop number : 53 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 25.15980338 Required : 28.00000000 Info(hartfock): self-consistent loop number : 54 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 25.23980023 Required : 28.00000000 Info(hartfock): self-consistent loop number : 55 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 25.37585820 Required : 28.00000000 Info(hartfock): self-consistent loop number : 56 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 25.15597218 Required : 28.00000000 Info(hartfock): self-consistent loop number : 57 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 25.25710986 Required : 28.00000000 Info(hartfock): self-consistent loop number : 58 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 25.15828916 Required : 28.00000000 Info(hartfock): self-consistent loop number : 59 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 25.39672461 Required : 28.00000000 Info(hartfock): self-consistent loop number : 60 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 25.28597171 Required : 28.00000000 Info(hartfock): self-consistent loop number : 61 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 25.14482737 Required : 28.00000000 Info(hartfock): self-consistent loop number : 62 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 25.23193293 Required : 28.00000000 Info(hartfock): self-consistent loop number : 63 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 25.11616588 Required : 28.00000000 Info(hartfock): self-consistent loop number : 64 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 25.34184176 Required : 28.00000000 Info(hartfock): self-consistent loop number : 65 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 25.34884322 Required : 28.00000000 Info(hartfock): self-consistent loop number : 66 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 25.27259355 Required : 28.00000000 Info(hartfock): self-consistent loop number : 67 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 25.31416195 Required : 28.00000000 Info(hartfock): self-consistent loop number : 68 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 25.29929122 Required : 28.00000000 Info(hartfock): self-consistent loop number : 69 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 25.33490685 Required : 28.00000000 Info(hartfock): self-consistent loop number : 70 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 25.16981232 Required : 28.00000000 Info(hartfock): self-consistent loop number : 71 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 25.35098454 Required : 28.00000000 Info(hartfock): self-consistent loop number : 72 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 25.25011064 Required : 28.00000000 Info(hartfock): self-consistent loop number : 73 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 25.17945872 Required : 28.00000000 Info(hartfock): self-consistent loop number : 74 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 25.19688519 Required : 28.00000000 Info(hartfock): self-consistent loop number : 75 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 25.25147477 Required : 28.00000000 Info(hartfock): self-consistent loop number : 76 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 25.20386321 Required : 28.00000000 Info(hartfock): self-consistent loop number : 77 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 25.32797064 Required : 28.00000000 Info(hartfock): self-consistent loop number : 78 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 25.32621877 Required : 28.00000000 Info(hartfock): self-consistent loop number : 79 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 25.18883163 Required : 28.00000000 Info(hartfock): self-consistent loop number : 80 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 25.21070293 Required : 28.00000000 Info(hartfock): self-consistent loop number : 81 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 25.40426371 Required : 28.00000000 Info(hartfock): self-consistent loop number : 82 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 25.22462189 Required : 28.00000000 Info(hartfock): self-consistent loop number : 83 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 25.32496501 Required : 28.00000000 Info(hartfock): self-consistent loop number : 84 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 25.43025315 Required : 28.00000000 Info(hartfock): self-consistent loop number : 85 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 25.28904867 Required : 28.00000000 Info(hartfock): self-consistent loop number : 86 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 25.28535675 Required : 28.00000000 Info(hartfock): self-consistent loop number : 87 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 25.31347737 Required : 28.00000000 Info(hartfock): self-consistent loop number : 88 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 25.24064995 Required : 28.00000000 Info(hartfock): self-consistent loop number : 89 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 25.26131748 Required : 28.00000000 Info(hartfock): self-consistent loop number : 90 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 25.32601987 Required : 28.00000000 Info(hartfock): self-consistent loop number : 91 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 25.20580074 Required : 28.00000000 Info(hartfock): self-consistent loop number : 92 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 25.02357463 Required : 28.00000000 Info(hartfock): self-consistent loop number : 93 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 25.32440186 Required : 28.00000000 Info(hartfock): self-consistent loop number : 94 Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 25.36303607 Required : 28.00000000 Info(hartfock): self-consistent loop number : 95 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 25.41747856 Required : 28.00000000 Info(hartfock): self-consistent loop number : 96 Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 25.24262723 Required : 28.00000000 Info(hartfock): self-consistent loop number : 97 Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 25.32110303 Required : 28.00000000 Info(hartfock): self-consistent loop number : 98 Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 25.29918670 Required : 28.00000000 Info(hartfock): self-consistent loop number : 99 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 25.40551089 Required : 28.00000000 Info(hartfock): self-consistent loop number : 100 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 25.19939570 Required : 28.00000000 Info(hartfock): self-consistent loop number : 101 Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 25.19039306 Required : 28.00000000 Info(hartfock): self-consistent loop number : 102 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 25.23080631 Required : 28.00000000 Info(hartfock): self-consistent loop number : 103 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 25.32943642 Required : 28.00000000 Info(hartfock): self-consistent loop number : 104 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 25.15096126 Required : 28.00000000 Info(hartfock): self-consistent loop number : 105 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 25.20496364 Required : 28.00000000 Info(hartfock): self-consistent loop number : 106 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 25.36730257 Required : 28.00000000 Info(hartfock): self-consistent loop number : 107 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 25.45708507 Required : 28.00000000 Info(hartfock): self-consistent loop number : 108 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 25.31142472 Required : 28.00000000 Info(hartfock): self-consistent loop number : 109 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 25.16849192 Required : 28.00000000 Info(hartfock): self-consistent loop number : 110 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 25.34230512 Required : 28.00000000 Info(hartfock): self-consistent loop number : 111 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 25.25070993 Required : 28.00000000 Info(hartfock): self-consistent loop number : 112 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 25.27327545 Required : 28.00000000 Info(hartfock): self-consistent loop number : 113 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 25.38574139 Required : 28.00000000 Info(hartfock): self-consistent loop number : 114 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 25.21750643 Required : 28.00000000 Info(hartfock): self-consistent loop number : 115 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 25.32764145 Required : 28.00000000 Info(hartfock): self-consistent loop number : 116 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 25.23234354 Required : 28.00000000 Info(hartfock): self-consistent loop number : 117 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 25.11673379 Required : 28.00000000 Info(hartfock): self-consistent loop number : 118 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 25.21738622 Required : 28.00000000 Info(hartfock): self-consistent loop number : 119 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 25.06913167 Required : 28.00000000 Info(hartfock): self-consistent loop number : 120 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 25.10716130 Required : 28.00000000 Info(hartfock): self-consistent loop number : 121 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 25.22692241 Required : 28.00000000 Info(hartfock): self-consistent loop number : 122 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 25.36264462 Required : 28.00000000 Info(hartfock): self-consistent loop number : 123 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 25.27720452 Required : 28.00000000 Info(hartfock): self-consistent loop number : 124 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 25.26058450 Required : 28.00000000 Info(hartfock): self-consistent loop number : 125 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 25.31045232 Required : 28.00000000 Info(hartfock): self-consistent loop number : 126 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 25.11606567 Required : 28.00000000 Info(hartfock): self-consistent loop number : 127 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 25.24565021 Required : 28.00000000 Info(hartfock): self-consistent loop number : 128 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 25.26391583 Required : 28.00000000 Info(hartfock): self-consistent loop number : 129 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 25.20209084 Required : 28.00000000 Info(hartfock): self-consistent loop number : 130 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 25.36511657 Required : 28.00000000 Info(hartfock): self-consistent loop number : 131 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 25.25876219 Required : 28.00000000 Info(hartfock): self-consistent loop number : 132 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 25.31047593 Required : 28.00000000 Info(hartfock): self-consistent loop number : 133 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 25.14534452 Required : 28.00000000 Info(hartfock): self-consistent loop number : 134 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 25.22116301 Required : 28.00000000 Info(hartfock): self-consistent loop number : 135 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 25.40172963 Required : 28.00000000 Info(hartfock): self-consistent loop number : 136 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 25.26546257 Required : 28.00000000 Info(hartfock): self-consistent loop number : 137 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 25.20306465 Required : 28.00000000 Info(hartfock): self-consistent loop number : 138 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 25.25572067 Required : 28.00000000 Info(hartfock): self-consistent loop number : 139 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 25.28597061 Required : 28.00000000 Info(hartfock): self-consistent loop number : 140 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 25.30008443 Required : 28.00000000 Info(hartfock): self-consistent loop number : 141 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 25.23655771 Required : 28.00000000 Info(hartfock): self-consistent loop number : 142 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 25.31654793 Required : 28.00000000 Info(hartfock): self-consistent loop number : 143 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 25.36528647 Required : 28.00000000 Info(hartfock): self-consistent loop number : 144 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 25.15288156 Required : 28.00000000 Info(hartfock): self-consistent loop number : 145 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 25.34073885 Required : 28.00000000 Info(hartfock): self-consistent loop number : 146 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 25.27576242 Required : 28.00000000 Info(hartfock): self-consistent loop number : 147 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 25.36797952 Required : 28.00000000 Info(hartfock): self-consistent loop number : 148 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 25.24481393 Required : 28.00000000 Info(hartfock): self-consistent loop number : 149 Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 25.34956859 Required : 28.00000000 Info(hartfock): self-consistent loop number : 150 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 25.22503527 Required : 28.00000000 Info(hartfock): self-consistent loop number : 151 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 25.29175426 Required : 28.00000000 Info(hartfock): self-consistent loop number : 152 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 25.29988000 Required : 28.00000000 Info(hartfock): self-consistent loop number : 153 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 25.26362383 Required : 28.00000000 Info(hartfock): self-consistent loop number : 154 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 25.16112838 Required : 28.00000000 Info(hartfock): self-consistent loop number : 155 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 25.40609991 Required : 28.00000000 Info(hartfock): self-consistent loop number : 156 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 25.35292203 Required : 28.00000000 Info(hartfock): self-consistent loop number : 157 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 25.20677048 Required : 28.00000000 Info(hartfock): self-consistent loop number : 158 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 25.29458700 Required : 28.00000000 Info(hartfock): self-consistent loop number : 159 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 25.25986812 Required : 28.00000000 Info(hartfock): self-consistent loop number : 160 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 25.18518261 Required : 28.00000000 Info(hartfock): self-consistent loop number : 161 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 25.31412944 Required : 28.00000000 Info(hartfock): self-consistent loop number : 162 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 25.39659991 Required : 28.00000000 Info(hartfock): self-consistent loop number : 163 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 25.33665137 Required : 28.00000000 Info(hartfock): self-consistent loop number : 164 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 25.27340007 Required : 28.00000000 Info(hartfock): self-consistent loop number : 165 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 25.32518754 Required : 28.00000000 Info(hartfock): self-consistent loop number : 166 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 25.28701535 Required : 28.00000000 Info(hartfock): self-consistent loop number : 167 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 25.44789116 Required : 28.00000000 Info(hartfock): self-consistent loop number : 168 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 25.36483613 Required : 28.00000000 Info(hartfock): self-consistent loop number : 169 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 25.35219254 Required : 28.00000000 Info(hartfock): self-consistent loop number : 170 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 25.15657770 Required : 28.00000000 Info(hartfock): self-consistent loop number : 171 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 25.19783918 Required : 28.00000000 Info(hartfock): self-consistent loop number : 172 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 25.22180400 Required : 28.00000000 Info(hartfock): self-consistent loop number : 173 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 25.31186624 Required : 28.00000000 Info(hartfock): self-consistent loop number : 174 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 25.24334205 Required : 28.00000000 Info(hartfock): self-consistent loop number : 175 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 25.25423001 Required : 28.00000000 Info(hartfock): self-consistent loop number : 176 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 25.21806517 Required : 28.00000000 Info(hartfock): self-consistent loop number : 177 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 25.14513144 Required : 28.00000000 Info(hartfock): self-consistent loop number : 178 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 25.30514340 Required : 28.00000000 Info(hartfock): self-consistent loop number : 179 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 25.24234888 Required : 28.00000000 Info(hartfock): self-consistent loop number : 180 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 25.36924716 Required : 28.00000000 Info(hartfock): self-consistent loop number : 181 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 25.43136070 Required : 28.00000000 Info(hartfock): self-consistent loop number : 182 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 25.32608003 Required : 28.00000000 Info(hartfock): self-consistent loop number : 183 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 25.24045743 Required : 28.00000000 Info(hartfock): self-consistent loop number : 184 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 25.37376154 Required : 28.00000000 Info(hartfock): self-consistent loop number : 185 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 25.39605968 Required : 28.00000000 Info(hartfock): self-consistent loop number : 186 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 25.19022364 Required : 28.00000000 Info(hartfock): self-consistent loop number : 187 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 25.35471015 Required : 28.00000000 Info(hartfock): self-consistent loop number : 188 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 25.35289356 Required : 28.00000000 Info(hartfock): self-consistent loop number : 189 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 25.32662636 Required : 28.00000000 Info(hartfock): self-consistent loop number : 190 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 25.19429383 Required : 28.00000000 Info(hartfock): self-consistent loop number : 191 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 25.23649111 Required : 28.00000000 Info(hartfock): self-consistent loop number : 192 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 25.33234315 Required : 28.00000000 Info(hartfock): self-consistent loop number : 193 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 25.22846152 Required : 28.00000000 Info(hartfock): self-consistent loop number : 194 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 25.27758347 Required : 28.00000000 Info(hartfock): self-consistent loop number : 195 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 25.25722935 Required : 28.00000000 Info(hartfock): self-consistent loop number : 196 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 25.21371585 Required : 28.00000000 Info(hartfock): self-consistent loop number : 197 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 25.28356216 Required : 28.00000000 Info(hartfock): self-consistent loop number : 198 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 25.19989495 Required : 28.00000000 Info(hartfock): self-consistent loop number : 199 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 25.14515981 Required : 28.00000000 Info(hartfock): self-consistent loop number : 200 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 25.18447217 Required : 28.00000000 Info(exxengy): 1 of 16 k-points Info(exxengy): 3 of 16 k-points Info(exxengy): 9 of 16 k-points Info(exxengy): 11 of 16 k-points Info(exxengy): 13 of 16 k-points Info(exxengy): 15 of 16 k-points Info(exxengy): 7 of 16 k-points Info(exxengy): 5 of 16 k-points Info(exxengy): 10 of 16 k-points Info(exxengy): 16 of 16 k-points Info(exxengy): 4 of 16 k-points Info(exxengy): 6 of 16 k-points Info(exxengy): 14 of 16 k-points Info(exxengy): 12 of 16 k-points Info(exxengy): 8 of 16 k-points Info(exxengy): 2 of 16 k-points Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -580.163931813 TEST_000.OUT : -578.269952498 absolute difference : 1.89397931500 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.580163931813E-02 real 151m36.570s user 264m22.122s sys 6m12.617s + cp -rp tests.orig tests + sed -i 's#mpirun -n 4 ../../src/elk#../../elk#g' tests/test-mpi.sh + sed -i '/Failed/ a cat test.log' tests/test-mpi.sh + /usr/bin/make test-mpi + tee test-mpi.1_openmp.log cd tests; ./test-mpi.sh Running test in directory test_001... ERROR STOP Error termination. Backtrace: #0 0x7fffb7276873 in ??? #1 0x7fffb7277f43 in ??? #2 0x7fffb72799eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 3 (Cu) from 2.4000 to 1.9694 Info(checkmt): reduced muffin-tin radius of species 4 (O) from 1.8000 to 1.4770 Info(findsymcrys): atomic basis shift (lattice) : -0.5000000000 -0.5000000000 -0.5000000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 330.4323403 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 342.5645270 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 336.4868212 Required : 294.0000000 Warning(gndstate): failed to reach self-consistency after 4 loops Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 372.8017241 Required : 294.0000000 Info(elk): current task : 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 388.9004369 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 2467.014811 Required : 294.0000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 92218.57819 Required : 294.0000000 Warning(gndstate): failed to reach self-consistency after 4 loops Warning(linengy): could not find 12 linearisation energies in s.c. loop 4 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -104.8020001 -5.251500000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 75.00436877 Required : 294.0000000 Info(elk): current task : 115 Info(writeefg): electric field gradient written to EFG.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -25088.8810466 TEST_000.OUT : -17874.3012867 absolute difference : 7214.57975990 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.250888810466 Running test in directory test_002... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff79c96873 in ??? #1 0x7fff79c97f43 in ??? #2 0x7fff79c999eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.3202 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 19.12034847 Required : 26.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 18.74724039 Required : 26.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 19.39842055 Required : 26.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 19.57230418 Required : 26.00000000 Warning(gndstate): failed to reach self-consistency after 5 loops Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 19.27358142 Required : 26.00000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1270.55032940 TEST_000.OUT : -1180.91667326 absolute difference : 89.6336561400 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.127055032940E-01 Running test in directory test_003... ERROR STOP Error termination. Backtrace: #0 0x7fffa9bb6873 in ??? #1 0x7fffa9bb7f43 in ??? #2 0x7fffa9bb99eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1436 Info(findsymcrys): atomic basis shift (lattice) : 0.3650000000 0.3650000000 0.3650000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.87593671 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.87428762 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.79157153 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.73858845 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.71846150 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.71292417 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.71158154 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.71182778 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.71193924 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 10 loops Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.71190932 Required : 28.00000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -580.223475286 TEST_000.OUT : -580.290032085 absolute difference : 0.665567990000E-01 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.580223475286E-02 Running test in directory test_004... ERROR STOP Error termination. Backtrace: #0 0x7fff922a6873 in ??? #1 0x7fff922a7f43 in ??? #2 0x7fff922a99eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Li) from 1.8000 to 1.7782 Info(checkmt): reduced muffin-tin radius of species 2 (F) from 2.0000 to 1.9758 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 9.121207069 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 9.129808960 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 9.226985205 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 9.313622311 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 9.432643146 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 9.525910356 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 9.570569261 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 9.568221698 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 9.568696411 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 9.568735060 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 9.568817699 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 9.568827141 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 9.568827723 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 9.568827086 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 9.568826962 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 9.568826831 Required : 12.00000000 Info(elk): current task : 120 Info(genpmat): 1 of 8 k-points Info(genpmat): 5 of 8 k-points Info(genpmat): 2 of 8 k-points Info(genpmat): 3 of 8 k-points Info(genpmat): 4 of 8 k-points Info(genpmat): 6 of 8 k-points Info(genpmat): 7 of 8 k-points Info(genpmat): 8 of 8 k-points Info(writepmat): momentum matrix elements written to file PMAT.OUT Info(elk): current task : 121 Info(dielectric): dielectric tensor written to EPSILON_ij.OUT optical conductivity written to SIGMA_ij.OUT for components i = 1, j = 1 Info(elk): current task : 180 Info(epsinv): 1 of 8 q-points Info(epsinv): 2 of 8 q-points Info(epsinv): 3 of 8 q-points Info(epsinv): 4 of 8 q-points Info(epsinv): 5 of 8 q-points Info(epsinv): 6 of 8 q-points Info(epsinv): 7 of 8 q-points Info(epsinv): 8 of 8 q-points Info(writeepsinv): inverse RPA dielectric function, eps^(-1)(G,G',q,w), written to EPSINV.OUT Info(elk): current task : 185 Info(writehmlbse): setting up BSE Hamiltonian matrix Info(hmlxbse): 1 of 64 k-points Info(hmlxbse): 33 of 64 k-points Info(hmlxbse): 34 of 64 k-points Info(hmlxbse): 2 of 64 k-points Info(hmlxbse): 3 of 64 k-points Info(hmlxbse): 35 of 64 k-points Info(hmlxbse): 4 of 64 k-points Info(hmlxbse): 36 of 64 k-points Info(hmlxbse): 5 of 64 k-points Info(hmlxbse): 37 of 64 k-points Info(hmlxbse): 38 of 64 k-points Info(hmlxbse): 6 of 64 k-points Info(hmlxbse): 39 of 64 k-points Info(hmlxbse): 7 of 64 k-points Info(hmlxbse): 8 of 64 k-points Info(hmlxbse): 40 of 64 k-points Info(hmlxbse): 9 of 64 k-points Info(hmlxbse): 41 of 64 k-points Info(hmlxbse): 10 of 64 k-points Info(hmlxbse): 42 of 64 k-points Info(hmlxbse): 11 of 64 k-points Info(hmlxbse): 43 of 64 k-points Info(hmlxbse): 12 of 64 k-points Info(hmlxbse): 44 of 64 k-points Info(hmlxbse): 13 of 64 k-points Info(hmlxbse): 45 of 64 k-points Info(hmlxbse): 14 of 64 k-points Info(hmlxbse): 46 of 64 k-points Info(hmlxbse): 15 of 64 k-points Info(hmlxbse): 47 of 64 k-points Info(hmlxbse): 16 of 64 k-points Info(hmlxbse): 48 of 64 k-points Info(hmlxbse): 17 of 64 k-points Info(hmlxbse): 49 of 64 k-points Info(hmlxbse): 18 of 64 k-points Info(hmlxbse): 50 of 64 k-points Info(hmlxbse): 19 of 64 k-points Info(hmlxbse): 51 of 64 k-points Info(hmlxbse): 20 of 64 k-points Info(hmlxbse): 52 of 64 k-points Info(hmlxbse): 21 of 64 k-points Info(hmlxbse): 53 of 64 k-points Info(hmlxbse): 22 of 64 k-points Info(hmlxbse): 54 of 64 k-points Info(hmlxbse): 23 of 64 k-points Info(hmlxbse): 55 of 64 k-points Info(hmlxbse): 24 of 64 k-points Info(hmlxbse): 56 of 64 k-points Info(hmlxbse): 25 of 64 k-points Info(hmlxbse): 57 of 64 k-points Info(hmlxbse): 26 of 64 k-points Info(hmlxbse): 58 of 64 k-points Info(hmlxbse): 27 of 64 k-points Info(hmlxbse): 59 of 64 k-points Info(hmlxbse): 28 of 64 k-points Info(hmlxbse): 60 of 64 k-points Info(hmlxbse): 29 of 64 k-points Info(hmlxbse): 61 of 64 k-points Info(hmlxbse): 30 of 64 k-points Info(hmlxbse): 62 of 64 k-points Info(hmlxbse): 31 of 64 k-points Info(hmlxbse): 63 of 64 k-points Info(hmlxbse): 32 of 64 k-points Info(hmlxbse): 64 of 64 k-points Info(hmldbse): 33 of 64 k-points Info(hmldbse): 1 of 64 k-points Info(hmldbse): 34 of 64 k-points Info(hmldbse): 2 of 64 k-points Info(hmldbse): 35 of 64 k-points Info(hmldbse): 3 of 64 k-points Info(hmldbse): 36 of 64 k-points Info(hmldbse): 4 of 64 k-points Info(hmldbse): 37 of 64 k-points Info(hmldbse): 5 of 64 k-points Info(hmldbse): 38 of 64 k-points Info(hmldbse): 6 of 64 k-points Info(hmldbse): 39 of 64 k-points Info(hmldbse): 7 of 64 k-points Info(hmldbse): 40 of 64 k-points Info(hmldbse): 41 of 64 k-points Info(hmldbse): 8 of 64 k-points Info(hmldbse): 42 of 64 k-points Info(hmldbse): 9 of 64 k-points Info(hmldbse): 43 of 64 k-points Info(hmldbse): 44 of 64 k-points Info(hmldbse): 10 of 64 k-points Info(hmldbse): 45 of 64 k-points Info(hmldbse): 11 of 64 k-points Info(hmldbse): 46 of 64 k-points Info(hmldbse): 12 of 64 k-points Info(hmldbse): 47 of 64 k-points Info(hmldbse): 48 of 64 k-points Info(hmldbse): 13 of 64 k-points Info(hmldbse): 49 of 64 k-points Info(hmldbse): 14 of 64 k-points Info(hmldbse): 50 of 64 k-points Info(hmldbse): 15 of 64 k-points Info(hmldbse): 16 of 64 k-points Info(hmldbse): 51 of 64 k-points Info(hmldbse): 17 of 64 k-points Info(hmldbse): 52 of 64 k-points Info(hmldbse): 18 of 64 k-points Info(hmldbse): 53 of 64 k-points Info(hmldbse): 19 of 64 k-points Info(hmldbse): 54 of 64 k-points Info(hmldbse): 20 of 64 k-points Info(hmldbse): 55 of 64 k-points Info(hmldbse): 21 of 64 k-points Info(hmldbse): 22 of 64 k-points Info(hmldbse): 56 of 64 k-points Info(hmldbse): 23 of 64 k-points Info(hmldbse): 57 of 64 k-points Info(hmldbse): 24 of 64 k-points Info(hmldbse): 58 of 64 k-points Info(hmldbse): 25 of 64 k-points Info(hmldbse): 26 of 64 k-points Info(hmldbse): 59 of 64 k-points Info(hmldbse): 60 of 64 k-points Info(hmldbse): 27 of 64 k-points Info(hmldbse): 28 of 64 k-points Info(hmldbse): 61 of 64 k-points Info(hmldbse): 29 of 64 k-points Info(hmldbse): 62 of 64 k-points Info(hmldbse): 30 of 64 k-points Info(hmldbse): 63 of 64 k-points Info(hmldbse): 31 of 64 k-points Info(hmldbse): 32 of 64 k-points Info(hmldbse): 64 of 64 k-points Info(writehmlbse): BSE Hamiltonian matrix written to HMLBSE.OUT Info(elk): current task : 186 Info(writeevbse): diagonalising the BSE Hamiltonian matrix Info(writeevbse): BSE eigenvectors and eigenvalues written to EVBSE.OUT BSE eigenvalues written to EIGVAL_BSE.OUT Info(elk): current task : 187 Info(dielectric_bse): dielectric tensor written to EPSILON_BSE_ij.OUT for components i = 1, j = 1 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -106.907708837 TEST_000.OUT : -107.276177256 absolute difference : 0.368468419000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.106907708837E-02 Running test in directory test_005... Passed Running test in directory test_006... Passed Running test in directory test_007... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff9d486873 in ??? #1 0x7fff9d487f43 in ??? #2 0x7fff9d4899eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.675350338 -5.434400000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 27.02068224 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 26.69142393 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.97768827 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.87303211 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 26.04957358 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.930191504 -5.434400000 for s.c. loop 6 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.80632361 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.196187413 -5.434400000 for s.c. loop 7 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.28054583 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 26.25352891 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 24.61892234 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.709229916 -5.434400000 for s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.61573255 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 25.27422769 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.952622423 -5.434400000 for s.c. loop 12 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 25.98789532 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.479380410 -5.434400000 for s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 25.87786458 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.716293748 -5.434400000 for s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 25.34104964 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 24.99013770 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.488231183 -5.434400000 for s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 24.09730652 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.375544409 -5.434400000 for s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 25.65296737 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 25.74010351 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.666651432 -5.434400000 for s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 25.78728466 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.843148772 -5.434400000 for s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 25.53788037 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.408898020 -5.434400000 for s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 25.64234885 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.928847150 -5.434400000 for s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 25.22501798 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.470515503 -5.434400000 for s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 25.51937443 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.269050413 -5.434400000 for s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 25.39666247 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 25.14819644 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.473223228 -5.434400000 for s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 25.22694208 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.723900115 -5.434400000 for s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 25.50264301 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 25.93758090 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.965274804 -5.434400000 for s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 26.13826437 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 26.05174181 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.698261321 -5.434400000 for s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 26.02971844 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 25.98699050 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.824804469 -5.434400000 for s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 25.96174899 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 25.39104505 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 25.19070073 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.524082848 -5.434400000 for s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 25.61822866 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.142118047 -5.434400000 for s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 26.14198714 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.110044255 -5.434400000 for s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 25.58809800 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.972110658 -5.434400000 for s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 25.29399428 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.881183568 -5.434400000 for s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 24.73754876 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.672996016 -5.434400000 for s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 25.48777677 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 25.32893160 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.472557043 -5.434400000 for s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 25.83908308 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 25.77746136 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 25.42875873 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 25.42778768 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 26.07447200 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 25.87863167 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.901296305 -5.434400000 for s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 25.89969297 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.875138449 -5.434400000 for s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 25.18803926 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 26.02864778 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 26.64767043 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.705297814 -5.434400000 for s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 26.38297554 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.942130670 -5.434400000 for s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 26.18025715 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.390334203 -5.434400000 for s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 25.89688986 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 26.28469295 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.641669378 -5.434400000 for s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 25.66155222 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.437162614 -5.434400000 for s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 25.71983388 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.270249851 -5.434400000 for s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 26.09783658 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 25.77787229 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.607451745 -5.434400000 for s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 26.15653051 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.920904666 -5.434400000 for s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 25.90212286 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.598687768 -5.434400000 for s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 26.04474545 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 25.61055383 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.665189064 -5.434400000 for s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 26.00122787 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.748525012 -5.434400000 for s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 25.83008652 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.135078142 -5.434400000 for s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 25.64943466 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.746602079 -5.434400000 for s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 25.70760794 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.179631066 -5.434400000 for s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 25.38348725 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.793363341 -5.434400000 for s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 25.88492629 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 25.98235572 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.714357781 -5.434400000 for s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 25.27329580 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.486253750 -5.434400000 for s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 26.09492700 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.907699507 -5.434400000 for s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 25.28256979 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -9.949219133 -5.434400000 for s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 25.90660995 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.986668223 -5.434400000 for s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 25.36176933 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.591095799 -5.434400000 for s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 25.24086132 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 26.61538108 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 26.35329855 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 26.32066693 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.687198662 -5.434400000 for s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 26.21101101 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.906579982 -5.434400000 for s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 26.08719150 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.696617549 -5.434400000 for s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 25.39330694 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.637430528 -5.434400000 for s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 26.39509638 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.612140263 -5.434400000 for s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 26.05098536 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.775600378 -5.434400000 for s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 26.02379473 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.945697305 -5.434400000 for s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 25.94356450 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 26.07733060 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.265951040 -5.434400000 for s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 25.96120856 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.845061170 -5.434400000 for s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 26.02767131 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.963484962 -5.434400000 for s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 25.79068992 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.117095478 -5.434400000 for s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 25.52791216 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 24.14396281 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 25.65396497 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.515441444 -5.434400000 for s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 25.77075439 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.902737554 -5.434400000 for s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 25.37974808 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 24.83474016 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 26.28438123 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 26.11921542 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.738732690 -5.434400000 for s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 25.83796265 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 25.33809665 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 26.50901328 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 26.30661623 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.507107130 -5.434400000 for s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 26.19650175 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.774352224 -5.434400000 for s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 25.93842777 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.505543141 -5.434400000 for s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 25.93891630 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.105302702 -5.434400000 for s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 26.20642268 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.342525589 -5.434400000 for s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 25.68363470 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 25.85528735 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 25.40856665 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 25.84315987 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.609529290 -5.434400000 for s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 25.90929722 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.960932712 -5.434400000 for s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 25.83615202 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.019454225 -5.434400000 for s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 26.21012519 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.861683662 -5.434400000 for s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 25.44318528 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.774662671 -5.434400000 for s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 25.52709802 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.741420431 -5.434400000 for s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 26.00830373 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.533592050 -5.434400000 for s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 26.01916459 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.436421510 -5.434400000 for s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 25.79400392 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.086308812 -5.434400000 for s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 24.99942092 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.005424390 -5.434400000 for s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 25.68603133 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.732448370 -5.434400000 for s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 24.60347810 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.771830458 -5.434400000 for s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 25.70468999 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 25.87953367 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 25.73449364 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.687355396 -5.434400000 for s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 24.76001225 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.891356039 -5.434400000 for s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 25.10640565 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.674397238 -5.434400000 for s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 25.87971561 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 25.59667945 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 25.59269712 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 25.72073251 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 25.26777029 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 25.54458003 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.611184814 -5.434400000 for s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 25.20727678 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.487279297 -5.434400000 for s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 25.42181888 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.789333016 -5.434400000 for s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 25.86339832 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 25.96071179 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 25.26402827 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 25.08118927 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.062935862 -5.434400000 for s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 26.11974533 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 25.00892366 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.110804421 -5.434400000 for s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 26.07954575 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 25.53667542 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.159745268 -5.434400000 for s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 25.61456365 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.171502085 -5.434400000 for s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 25.82016683 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.551549677 -5.434400000 for s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 25.64248635 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.889833523 -5.434400000 for s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 25.29114913 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.984409772 -5.434400000 for s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 25.72407791 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.839131695 -5.434400000 for s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 26.02751398 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 25.76619941 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 25.50677532 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.463505456 -5.434400000 for s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 25.86020279 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.851194510 -5.434400000 for s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 25.93083151 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.994570721 -5.434400000 for s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 26.05570228 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.250162233 -5.434400000 for s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 26.01149162 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.168629685 -5.434400000 for s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 26.27062146 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.496897134 -5.434400000 for s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 26.14541665 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.482239105 -5.434400000 for s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 25.69166133 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.445484009 -5.434400000 for s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 26.03327231 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.002870036 -5.434400000 for s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 25.84260887 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.761541725 -5.434400000 for s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 25.50822022 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.839693414 -5.434400000 for s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 25.07487639 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.231619241 -5.434400000 for s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 25.07123106 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 25.54401137 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 25.82555872 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 25.75876539 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 25.71862064 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 24.41815458 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.285831808 -5.434400000 for s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 25.93021639 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.273545145 -5.434400000 for s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 25.81168370 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.082440968 -5.434400000 for s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 25.96687040 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.771845730 -5.434400000 for s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 25.06505717 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.494392681 -5.434400000 for s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 25.18781653 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 26.08820869 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 24.91429785 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 25.64362930 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 24.40943916 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 25.40548339 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.691239178 -5.434400000 for s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 25.52725075 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.330303018 -5.434400000 for s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 24.89785717 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.901256618 -5.434400000 for s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 25.49538562 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.684045326 -5.434400000 for s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 25.46628519 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 26.33631659 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.620382199 -5.434400000 for s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 26.06295198 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 25.81855846 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.698752442 -5.434400000 for s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 25.72092447 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.418425738 -5.434400000 for s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 25.79395271 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.488308638 -5.434400000 for s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 25.66205182 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.524155362 -5.434400000 for s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 26.48208674 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.142656202 -5.434400000 for s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 25.90440484 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -11.17122247 -5.434400000 for s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 26.28892143 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.801231183 -5.434400000 for s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 25.59262881 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.101697338 -5.434400000 for s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 25.84495947 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 25.60799957 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.705200835 -5.434400000 for s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 25.76680057 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.437138418 -5.434400000 for s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 25.82052064 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.200065801 -5.434400000 for s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 25.96541052 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.681005866 -5.434400000 for s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 25.56712270 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.762162658 -5.434400000 for s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 25.92594973 Required : 39.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.117415626 -5.434400000 for s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 25.74282938 Required : 39.00000000 Info(elk): current task : 15 Info(writelsj): muffin-tin L, S and J expectation values written to LSJ.OUT Info(elk): current task : 16 Info(writelsj): muffin-tin L, S and J expectation values for each k-point and state in kstlist written to LSJ_KST.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1515.75083630 TEST_000.OUT : -1529.19352564 absolute difference : 13.4426893400 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.151575083630E-01 Running test in directory test_008... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff86cd6873 in ??? #1 0x7fff86cd7f43 in ??? #2 0x7fff86cd99eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 37.79254722 Required : 52.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 34.71020560 Required : 52.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 34.23747923 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.733382179 -5.434400000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 34.81854697 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.623868385 -5.434400000 for s.c. loop 5 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 34.74228913 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.775257873 -5.434400000 for s.c. loop 6 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 34.72473344 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.736158382 -5.434400000 for s.c. loop 7 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 33.70699935 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 39.76600250 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 9 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -17.39781597 -5.434400000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 64.40732733 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 37.49416397 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 37.66512868 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 12 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -13.25517841 -5.434400000 for s.c. loop 12 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 49.36179652 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 13 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -83.21598964 -5.434400000 for s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 177.4155126 Required : 52.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 33.66669216 Required : 52.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 33.99233078 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.116043824 -5.434400000 for s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 33.85429186 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.686353818 -5.434400000 for s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 33.99585200 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.616297605 -5.434400000 for s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 33.34633029 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 36.36322718 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 20 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -17.82320352 -5.434400000 for s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 39.33202698 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 21 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -46.71925610 -5.434400000 for s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 82.42740821 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 22 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -10825.01155 -5.434400000 for s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 558.0131143 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 23 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 51.17700350 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 51.00312341 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 50.57945476 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 49.04721211 Required : 52.00000000 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 37.48641805 Required : 52.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 33.91683010 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.599880828 -5.434400000 for s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 33.74301294 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 40.64961310 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 37.35052904 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 33.34420953 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 33.45850800 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 32.83949922 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 34.24891082 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 33.02690058 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 33.40996364 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 33.22919203 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 33.58644237 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 33.80185464 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 33.28379835 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 33.13721382 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 33.25287368 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 33.35108616 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 33.61409626 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 33.61185482 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 33.36035941 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 33.58611470 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 33.43807784 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 33.07685056 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 33.42154016 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 33.34464512 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 33.46135685 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 33.66869337 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 33.58583835 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 33.48815601 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 33.23735262 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 33.66879271 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 33.52606794 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 33.44815071 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 33.16142996 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 33.40973966 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 33.21335514 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 33.47421207 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 33.04023573 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 33.38331277 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 33.50803410 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 33.34154598 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 33.48352931 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 33.26954688 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 33.53458779 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 33.38566033 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 33.41469972 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 33.39093630 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 33.57615938 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 34.10679087 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 33.84346851 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 33.61741413 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 33.67368473 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 33.74731868 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 33.11933329 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 34.00458970 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 33.67258396 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 33.66713519 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 33.83353878 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 33.57888313 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 33.58334311 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 33.86992090 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 33.44048322 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 33.87363205 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 33.41232039 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 33.60173863 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 33.42974376 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 33.62391957 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 33.53219068 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 33.57996179 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 33.67359899 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 33.73055864 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 33.32720955 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 33.35342090 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 33.78089834 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 33.47474452 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 33.77677721 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 33.31273499 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 33.05115653 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 33.63496296 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 33.66730536 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 33.53275525 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 33.49157221 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 33.57373843 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 33.51250541 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 33.58053978 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 33.49986641 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 33.52466099 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 33.50588921 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 33.48453192 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 33.90309240 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 33.68347033 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 33.40725985 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 33.53845664 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 33.98102511 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 33.41108958 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 33.32911706 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 33.61422224 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 33.27672723 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 33.47668367 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 33.43640461 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 33.75176630 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 33.62838583 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 33.53627427 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 33.43460027 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 33.35547531 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 33.84637612 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 33.51565270 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 33.57094477 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 33.52254262 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 34.02872358 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 33.24895390 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 33.66906008 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 33.26894161 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 33.61381119 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 33.38226567 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 33.72012728 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 33.32774875 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 33.50515397 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 33.58339581 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 33.69997730 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 33.41974057 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 33.63668382 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 33.52783583 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 33.53680540 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 33.28393840 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 33.57036615 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 33.69798554 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 33.90174430 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 33.69295564 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 33.70603294 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 33.64883771 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 33.52695661 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 33.70222953 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 33.28405400 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 32.94598766 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 33.52763930 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 33.54114468 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 33.66201581 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 33.03695885 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 33.37651130 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 33.57794100 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 33.44591536 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 32.93627928 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 33.06472133 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 33.21508653 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 33.26990116 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 33.10594164 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 33.64836070 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 33.66013694 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 33.35923391 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 33.32530322 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 33.50618148 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 33.42501846 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 33.43973976 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 33.44176499 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 33.27234957 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 33.20364870 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 33.46608695 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 33.23410228 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 33.38443993 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 33.00976341 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 33.55118061 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 33.16567264 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 33.42448909 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 33.33304094 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 33.54277216 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 33.20090324 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 33.35544599 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 33.16555139 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 33.01532300 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 33.56385385 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 33.49001207 Required : 52.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 33.42035024 Required : 52.00000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -2540.92552965 TEST_000.OUT : -2442.95980618 absolute difference : 97.9657234700 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.254092552965E-01 Running test in directory test_009... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (B) from 1.8000 to 1.6129 Info(checkmt): reduced muffin-tin radius of species 2 (N+) from 1.4500 to 1.2993 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 201 The leading minor of the overlap matrix of order 94 is not positive definite Order of overlap matrix : 107 Running test in directory test_010... ERROR STOP Error termination. Backtrace: #0 0x7fffabeb6873 in ??? #1 0x7fffabeb7f43 in ??? #2 0x7fffabeb99eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (O) from 1.8000 to 0.9906 Info(checkmt): reduced muffin-tin radius of species 2 (H) from 1.4000 to 0.7704 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 8.727117532 Required : 10.00000000 Warning(gndstate): failed to reach self-consistency after 2 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 7.893320245 Required : 10.00000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -79.0782174419 TEST_000.OUT : -46.7988991490 absolute difference : 32.2793182929 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.790782174419E-03 Running test in directory test_011... ERROR STOP Error termination. Backtrace: #0 0x7fff8ecd6873 in ??? #1 0x7fff8ecd7f43 in ??? #2 0x7fff8ecd99eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.80924075 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 2 loops Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.80736252 Required : 28.00000000 Info(elk): current task : 5 Info(genkmat): 2 of 2 k-points Info(genkmat): 1 of 2 k-points Info(hartfock): self-consistent loop number : 1 Info(eveqnhf): 2 of 2 k-points Info(eveqnhf): 1 of 2 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.23746184 Required : 28.00000000 Info(hartfock): self-consistent loop number : 2 Info(eveqnhf): 2 of 2 k-points Info(eveqnhf): 1 of 2 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 24.41892710 Required : 28.00000000 Info(exxengy): 2 of 2 k-points Info(exxengy): 1 of 2 k-points Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -579.532549312 TEST_000.OUT : -578.903445036 absolute difference : 0.629104276000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.579532549312E-02 Running test in directory test_012... Passed Running test in directory test_013... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG Passed Running test in directory test_014... ERROR STOP Error termination. Backtrace: #0 0x7fffb5f06873 in ??? #1 0x7fffb5f07f43 in ??? #2 0x7fffb5f099eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 26.14171296 Required : 28.00000000 Info(oepvcl): 5 of 8 k-points Info(oepvcl): 1 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepmain): done 10 iterations of 100 Info(oepmain): done 20 iterations of 100 Info(oepmain): done 30 iterations of 100 Info(oepmain): done 40 iterations of 100 Info(oepmain): done 50 iterations of 100 Info(oepmain): done 60 iterations of 100 Info(oepmain): done 70 iterations of 100 Info(oepmain): done 80 iterations of 100 Info(oepmain): done 90 iterations of 100 Info(oepmain): done 100 iterations of 100 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 26.12742738 Required : 28.00000000 Info(oepvcl): 5 of 8 k-points Info(oepvcl): 1 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepmain): done 10 iterations of 100 Info(oepmain): done 20 iterations of 100 Info(oepmain): done 30 iterations of 100 Info(oepmain): done 40 iterations of 100 Info(oepmain): done 50 iterations of 100 Info(oepmain): done 60 iterations of 100 Info(oepmain): done 70 iterations of 100 Info(oepmain): done 80 iterations of 100 Info(oepmain): done 90 iterations of 100 Info(oepmain): done 100 iterations of 100 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 26.08191577 Required : 28.00000000 Info(oepvcl): 5 of 8 k-points Info(oepvcl): 1 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepmain): done 10 iterations of 100 Info(oepmain): done 20 iterations of 100 Info(oepmain): done 30 iterations of 100 Info(oepmain): done 40 iterations of 100 Info(oepmain): done 50 iterations of 100 Info(oepmain): done 60 iterations of 100 Info(oepmain): done 70 iterations of 100 Info(oepmain): done 80 iterations of 100 Info(oepmain): done 90 iterations of 100 Info(oepmain): done 100 iterations of 100 Warning(gndstate): failed to reach self-consistency after 4 loops Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 26.07564996 Required : 28.00000000 Info(oepvcl): 5 of 8 k-points Info(oepvcl): 1 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepmain): done 10 iterations of 100 Info(oepmain): done 20 iterations of 100 Info(oepmain): done 30 iterations of 100 Info(oepmain): done 40 iterations of 100 Info(oepmain): done 50 iterations of 100 Info(oepmain): done 60 iterations of 100 Info(oepmain): done 70 iterations of 100 Info(oepmain): done 80 iterations of 100 Info(oepmain): done 90 iterations of 100 Info(oepmain): done 100 iterations of 100 Info(exxengy): 1 of 8 k-points Info(exxengy): 5 of 8 k-points Info(exxengy): 2 of 8 k-points Info(exxengy): 6 of 8 k-points Info(exxengy): 3 of 8 k-points Info(exxengy): 7 of 8 k-points Info(exxengy): 4 of 8 k-points Info(exxengy): 8 of 8 k-points Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -530.380788873 TEST_000.OUT : -532.109453793 absolute difference : 1.72866492000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.530380788873E-02 Running test in directory test_015... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff7fdc6873 in ??? #1 0x7fff7fdc7f43 in ??? #2 0x7fff7fdc99eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.2267 Info(checkmt): reduced muffin-tin radius of species 2 (O) from 1.8000 to 1.6700 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -24.11500610 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 254.3518233 Required : 72.00000000 Info(findlambda): lambda obtained in 8 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 51.33599999 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 9 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 51.62620460 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 50.82916934 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 49.03699929 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 44.41305738 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 46.01533199 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 45.52049094 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 55.29334264 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 14 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 47.28130734 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 69.95303840 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 12 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 49.46720003 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 48.29584447 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 46.75749884 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 47.23149215 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 86.08120639 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 17 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -9.665998956 -4.590500000 for s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 208.0651084 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 47.25436283 Required : 72.00000000 Info(findlambda): lambda obtained in 9 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 43.49647687 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 42.33781911 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 44.08479857 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 51.94019914 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 49.19313106 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 15 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 46.63572184 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 113.6854526 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 53.00890977 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 49.99444129 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 62.81663976 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 47.95052964 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 47.20217848 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 49.57490509 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 48.60562143 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 48.91849755 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 51.80602312 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 48.50397089 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 50.61957317 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 52.87121336 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 52.11706608 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 51.62724950 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 50.00552807 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 50.18076173 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 50.17593156 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 51.38739923 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 51.30721668 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 49.13411139 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 52.81357471 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 50.27181680 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 51.73190078 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 50.55952202 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 52.36342713 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 52.86990398 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 50.53819113 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 50.10909117 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 51.36798710 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 50.30279793 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 50.37516992 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 51.99156295 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 49.92731868 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 50.34416219 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 51.91096111 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 51.60201095 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 49.22551381 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 52.67110790 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 49.74288903 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 51.62890832 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 49.62302388 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 50.38685647 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 51.95574518 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 50.83450022 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 49.91056045 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 51.59882459 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 51.64724211 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 49.66575016 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 51.65562886 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 50.86028938 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 50.28627666 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 51.68085332 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 50.56874346 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 50.39362238 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 50.26036010 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 52.21270929 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 50.46705764 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 51.17368089 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 50.19079469 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 51.35219685 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 50.61519538 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 50.43515492 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 51.17249944 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 51.52478741 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 51.33500748 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 49.40214129 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 51.88249309 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 50.67853309 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 51.41680386 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 51.53501358 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 49.83918656 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 50.65553176 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 50.63041601 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 50.55055126 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 51.86368427 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 50.06792742 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 51.50289937 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 49.92950136 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 51.17078221 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 51.83748851 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 50.66056701 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 52.21399392 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 50.88090967 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 51.71733293 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 51.11402081 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 51.10134129 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 51.04240597 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 51.24533115 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 50.67481163 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 50.49755296 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 50.99144372 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 50.26800880 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 50.42464594 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 51.04410300 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 50.87794613 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 50.94299783 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 50.21670836 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 50.42967812 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 52.80574960 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 49.78456769 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 50.21232937 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 51.69681426 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 50.36923338 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 51.06125832 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 51.21476827 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 52.09030497 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 51.21256708 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 50.63165683 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 51.32096742 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 50.59741359 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 51.72564612 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 50.91650301 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 50.56259482 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 51.74588871 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 49.99475290 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 51.40622598 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 49.39412626 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 52.11122385 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 51.08169131 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 51.27925374 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 50.47062584 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 50.53326950 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 52.54391394 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 50.64740398 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 50.76564930 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 51.72942421 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 50.63637764 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 51.38459259 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 50.48197676 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 49.97123528 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 51.45201796 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 50.79871868 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 49.82303540 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 50.36124991 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 52.03201070 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 52.29785138 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 50.77479136 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 49.97199805 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 52.26768946 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 50.20361311 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 51.47696691 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 51.28217975 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 50.88819495 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 50.29876809 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 50.22110435 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 50.79567968 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 50.73362868 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 51.04883590 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 51.10563233 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 49.79486741 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 52.51595659 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 49.88130539 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 51.19615612 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 50.80034978 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 51.11504162 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 50.80817572 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 51.37735368 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 50.56443067 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 50.46548812 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 52.17263374 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 51.65248810 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 51.48115973 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 51.54938588 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 50.13340753 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 51.45341634 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 50.92432603 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 51.03212658 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 51.29094226 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 50.54545668 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 50.89414494 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 50.55651400 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 51.62697525 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 51.16255012 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 52.03796439 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 50.22663510 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Info(elk): current task : 400 Info(writetm): Tensor moment decomposition of density matrix in the spherical basis written to TENSMOM.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -3186.18768675 TEST_000.OUT : -3096.07088818 absolute difference : 90.1167985700 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.318618768675E-01 Running test in directory test_016... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff8dea6873 in ??? #1 0x7fff8dea7f43 in ??? #2 0x7fff8dea99eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (U) from 3.0000 to 2.9601 Info(checkmt): reduced muffin-tin radius of species 2 (S) from 2.2000 to 2.1708 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 96.68465848 Required : 108.0000000 Info(findlambda): lambda obtained in 8 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 96.56750490 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 96.42541832 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 96.18780467 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 96.45918407 Required : 108.0000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 94.56939518 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 95.78885900 Required : 108.0000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 95.71484743 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 95.39754208 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(gndstate): failed to reach self-consistency after 10 loops Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 95.34358453 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Info(elk): current task : 400 Info(writetm): Tensor moment decomposition of density matrix in the spherical basis written to TENSMOM.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -28328.4711959 TEST_000.OUT : -28506.7926481 absolute difference : 178.321452200 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.283284711959 Running test in directory test_017... Passed Running test in directory test_018... ERROR STOP Error termination. Backtrace: #0 0x7fff99406873 in ??? #1 0x7fff99407f43 in ??? #2 0x7fff994099eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 40.27411364 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 40.27582733 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 40.40714652 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 40.53251090 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 40.59937047 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 40.65578279 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 40.68438215 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 40.68797771 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 40.68842795 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 40.68884393 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 40.68864150 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 40.68858904 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 40.68858187 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 40.68858046 Required : 41.00000000 Info(elk): current task : 205 Info(phonon): working on DYN_Q0000_0000_0000_S01_A001_P1.OUT Info(phonon): working on DYN_Q0102_0000_0000_S01_A001_P1.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0102_0102_0102_S01_A001_P1.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0000_0000_0000_S01_A001_P2.OUT Info(phonon): working on DYN_Q0102_0000_0000_S01_A001_P2.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0102_0102_0102_S01_A001_P2.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0000_0000_0000_S01_A001_P3.OUT Info(phonon): working on DYN_Q0102_0000_0000_S01_A001_P3.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0102_0102_0102_S01_A001_P3.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(dyntask): nothing more to do Info(elk): current task : 210 Info(phdos): phonon density of states written to PHDOS.OUT thermodynamic properties written to THERMO.OUT Info(elk): current task : 500 Error(testcheck): variable 10 outside tolerance for quantity 'phonon DOS' TEST_210.OUT_ (correct value) : 0.448026778003E-03 TEST_210.OUT : 201.247099116 absolute difference : 201.246651089 required relative tolerance : 0.100000000000E-01 required absolute tolerance : 0.448026778003E-05 Running test in directory test_019... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.3297 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.898542575 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 71.72901335 Required : 28.00000000 Info(findlambda): lambda obtained in 8 iterations Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -15.87959426 -4.590500000 for s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 22.30737612 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 19.66901158 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 19.46456161 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 19.58197475 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 19.82310668 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 19.53050032 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 17.91737158 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 20.97578186 Required : 28.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 13 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 20.63353008 Required : 28.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 20.84414321 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 12 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 22.92701582 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 20.93823706 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 20.65965972 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 20.06731064 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 20.13865648 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 20.59737199 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 20.64143937 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 20.25523034 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 20.60891725 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 20.34637997 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 19.87890690 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 20.44969636 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 20.26973532 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 20.08774565 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 20.05143475 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 20.52380301 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 20.49746453 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 20.31643640 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 20.13430150 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 21.06960514 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 20.84519017 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 20.60579340 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 20.59522796 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 20.59560797 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 20.60516612 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 20.59136850 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 20.69354413 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 20.24720726 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 20.40043735 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 20.58448175 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 20.64222867 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 20.34384085 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 20.50253886 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 20.46287464 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 20.29719075 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 20.93598533 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 20.50426172 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 20.33254335 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 20.58543901 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 20.19737659 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 20.63953592 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 20.18271998 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 20.39754174 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 20.35184503 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 19.95893854 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 20.38091570 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 20.59072609 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 20.12179896 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 20.24371540 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 19.96988920 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 20.43256199 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 20.53063636 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 20.56824695 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 20.94182325 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 20.41143387 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 20.44802577 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 20.03214464 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 20.23990315 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 20.38471953 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 19.68123014 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 20.14837750 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 20.29890711 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 19.96025497 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 19.95820456 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 20.41803936 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 20.38144526 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 20.55229768 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 20.03710417 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 20.59400337 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 20.45923532 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 20.19963720 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 20.71020331 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 20.12615119 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 20.81852421 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 20.27495579 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 20.49129094 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 20.52750083 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 20.44338596 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 20.67906085 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 20.41025773 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 20.22571236 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 20.45563473 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 20.29518385 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 20.45412343 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 20.59094935 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 20.44853899 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 20.29382198 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 20.71138124 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 20.43073597 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 20.39601667 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 20.47854615 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 20.52938902 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 20.26979800 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 20.37482374 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 20.29831915 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 20.42044209 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 20.65722638 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 20.25561220 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 20.32898436 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 20.18850323 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 20.93754727 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 20.15363452 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 20.05530891 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 20.84461633 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 20.29922756 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 20.03256503 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 20.13099627 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 20.53834769 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 20.60718876 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 20.62838323 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 20.83220755 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 20.51267918 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 20.52238570 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 20.52618728 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 20.46324618 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 20.40740092 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 20.36744164 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 20.26206580 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 20.55823724 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 20.17661780 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 20.08629987 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 20.54121631 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 20.44564444 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 20.48469358 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 20.34083764 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 20.49053952 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 20.30584577 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 20.72571596 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 20.15160789 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 20.69678369 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 20.24431377 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 20.10751745 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 20.13257352 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 20.70500693 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 20.41464718 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 20.08688291 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 20.18296738 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 20.50781295 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 20.20175635 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 20.56953977 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 20.28654446 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 20.28775656 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 20.57458758 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 19.99288373 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 20.61044787 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 20.49535985 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 20.52074951 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 20.30169473 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 20.71123908 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 20.21673045 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 20.40961306 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 20.23925985 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 20.15601414 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 20.55623365 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 20.14744135 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 19.97505635 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 20.12768839 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 20.37261815 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 20.03156592 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 20.57472988 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 20.14524517 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 20.14375681 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 20.04848314 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 20.20725697 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 20.27289003 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 20.07764078 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 19.99953343 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 20.21485627 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 20.22375318 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 20.07212234 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 20.22227709 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 19.94575129 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 19.97657246 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 20.24946144 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 20.20899270 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 20.72092362 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 20.10400274 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 20.33040819 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 20.58383743 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 20.36438619 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 20.89277009 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 19.96307376 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 20.23238717 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 20.46614355 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 20.44461146 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 20.35992287 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 20.79157826 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 20.32037282 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 20.21075835 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Info(elk): current task : 450 Info(genafieldt): Time-dependent A-field written to AFIELDT.OUT Laser pulse and ramp parameters written to TD_INFO.OUT 1 atomic unit of time is 24.18884327 attoseconds Total simulation time : 50.00000000 in attoseconds : 1209.442163 Info(elk): current task : 460 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 51 The leading minor of the overlap matrix of order 19 is not positive definite Order of overlap matrix : 32 Running test in directory test_020... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff8cf76873 in ??? #1 0x7fff8cf77f43 in ??? #2 0x7fff8cf799eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Li) from 1.8000 to 1.7782 Info(checkmt): reduced muffin-tin radius of species 2 (F) from 2.0000 to 1.9758 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 23.84125720 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 35.78035563 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 34.01256200 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.44731695 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 22.38362356 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 20.17233540 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 18.21912205 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 17.83526291 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 18.28788203 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 15.51031692 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 14.37025776 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 14.27282431 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 13.88216272 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 13.21535892 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 13.27164253 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 12.93030817 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 10.21583828 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 192348.2546 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 19 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -62566.78641 -3.878400000 for s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 0.1115053000E-49 Required : 12.00000000 Warning(rdirac): maximum iterations exceeded Warning(linengy): could not find 3 linearisation energies in s.c. loop 20 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -1113281.006 -3.878400000 for s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 0.3531191555E-51 Required : 12.00000000 Warning(rdirac): maximum iterations exceeded Warning(linengy): could not find 3 linearisation energies in s.c. loop 21 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -165053.4422 -3.878400000 for s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 0.4983725113E-52 Required : 12.00000000 Warning(rdirac): maximum iterations exceeded Warning(linengy): could not find 3 linearisation energies in s.c. loop 22 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -14577.02315 -3.878400000 for s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 0.9051898601E-65 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 23 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -1777.119927 -3.878400000 for s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 0.1407681671E-04 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 24 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4758.559089 -3.878400000 for s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 1.400532245 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 25 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -396.5053594 -3.878400000 for s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 2.026905688 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 26 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -333.1859488 -3.878400000 for s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 0.9038820338-149 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 27 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.578404100 -3.878400000 for s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 11.12565713 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 9.978979292 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 12.37723869 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 9.655260824 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 11.71461538 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 13.10765691 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 11.15301081 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 16.70967245 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 28.10990147 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 20.30953114 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 39.29005196 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 18.80649579 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 33.67898579 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 37.44621403 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 14.41254946 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 19.05997354 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 17.83802035 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 16.67221772 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 16.59648586 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 17.30480390 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 17.02033111 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 16.99835301 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 16.71687964 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 16.86564220 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 16.78782829 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 16.81088372 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 16.81631135 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 16.80460790 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 16.81294969 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 16.81109064 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 16.81289464 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 16.81344600 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 16.81386968 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 16.81397946 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 16.81402843 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 16.81404752 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 16.81402265 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 16.81404812 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 16.81403375 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 16.81403845 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 16.81403693 Required : 12.00000000 Info(elk): current task : 600 Info(genpmat): 1 of 8 k-points Info(genpmat): 5 of 8 k-points Info(genpmat): 6 of 8 k-points Info(genpmat): 7 of 8 k-points Info(genpmat): 2 of 8 k-points Info(genpmat): 3 of 8 k-points Info(genpmat): 8 of 8 k-points Info(genpmat): 4 of 8 k-points Info(epsinv): 1 of 3 q-points Info(epsinv): 2 of 3 q-points Info(epsinv): 3 of 3 q-points Info(gwsefm): 1 of 8 k-points Info(gwsefm): 5 of 8 k-points Info(gwsefm): 6 of 8 k-points Info(gwsefm): 2 of 8 k-points Info(gwsefm): 7 of 8 k-points Info(gwsefm): 3 of 8 k-points Info(gwsefm): 8 of 8 k-points Info(gwsefm): 4 of 8 k-points Info(gwsefm): GW self-energy at the fermionic frequencies written to GWSEFM.OUT Info(elk): current task : 610 Info(gwspecf): 1 of 8 k-points Info(gwspecf): 5 of 8 k-points Info(gwspecf): 2 of 8 k-points Info(gwspecf): 6 of 8 k-points Info(gwspecf): 3 of 8 k-points Info(gwspecf): 7 of 8 k-points Info(gwspecf): 4 of 8 k-points Info(gwspecf): 8 of 8 k-points Info(gw): GW spectral functions and Kohn-Sham eigenvalues written to GWSF_Kkkkkkk.OUT for all k-points Total GW spectral function written to GWTSF.OUT Fermi energy for the Kohn-Sham eigenvalues is at zero in plots Fermi energy for the GW spectral function is undetermined Spectral function units are states/Hartree/unit cell Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -106.905850836 TEST_000.OUT : -108.957413488 absolute difference : 2.05156265200 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.106905850836E-02 Running test in directory test_021... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffa4bd6873 in ??? #1 0x7fffa4bd7f43 in ??? #2 0x7fffa4bd99eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Mn) from 2.4000 to 2.3708 Info(checkmt): reduced muffin-tin radius of species 2 (O) from 1.8000 to 1.7781 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 45.45915193 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 45.68827026 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 46.55221853 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -179.1236148 -5.137200000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 455.3313565 Required : 66.00000000 Warning(linengy): could not find 4 linearisation energies in s.c. loop 5 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 60.42818019 Required : 66.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 6 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 56.17741688 Required : 66.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 7 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 52.40731011 Required : 66.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 53.27014225 Required : 66.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 52.44980070 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 46.55239891 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.522155741 -5.137200000 for s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 44.43016432 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 44.23982732 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 43.40063609 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 43.48923811 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 43.86117966 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 43.85540011 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 43.71624871 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 43.58704792 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 42.53694726 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 43.68932076 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.984734488 -5.137200000 for s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 44.29523515 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 43.07764637 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 42.95319329 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 43.76154089 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 43.78726908 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 43.85855249 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 43.83322074 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 43.15035787 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 43.44643989 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 43.22194292 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 43.58937745 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 43.48679705 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 43.77806328 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 42.87538441 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 42.42513359 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 42.87874030 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 43.48086620 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 43.17959986 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 42.78337784 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 43.12401016 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 42.63860149 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 43.33027010 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 42.75931984 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 43.64096415 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 43.35704673 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 43.26689598 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 43.27149693 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 42.52845376 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 43.55562567 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 43.04907913 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 43.12267491 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 43.62324310 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 43.40585876 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 43.39475335 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 43.12334100 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 43.81266364 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 43.28358582 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 42.96041294 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 44.03880352 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 42.74572409 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 42.38872931 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 43.22612589 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 43.40865717 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 43.40446045 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.458883276 -5.137200000 for s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 42.96151400 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 43.32349394 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 43.02056227 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 44.38875839 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 43.30743636 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 43.68807492 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 43.42443394 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 42.74264919 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 43.28997558 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 43.47015452 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 43.14572235 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.198113126 -5.137200000 for s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 43.54401796 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.233030911 -5.137200000 for s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 42.81777443 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 44.12600482 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 43.59388660 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 43.38601670 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 43.11802054 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 43.79047566 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 42.97612234 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 42.60019217 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 43.03939515 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 43.61543225 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 43.66373153 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 43.52587621 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 43.48070574 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 43.52201008 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 43.32429508 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 43.18391357 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 42.82657480 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 43.23173211 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 43.65453977 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 43.41062822 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 43.77952639 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 43.72878073 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.067596187 -5.137200000 for s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 42.50663687 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 43.58798586 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 43.14241759 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 43.17093256 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 43.20567133 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 43.27385883 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 42.65694345 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 42.87359963 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 43.04897747 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 43.36830280 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 43.02022937 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.524704945 -5.137200000 for s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 42.70677525 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.063834434 -5.137200000 for s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 41.87199787 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.721809366 -5.137200000 for s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 42.74416747 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 43.29691782 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 43.21753761 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 42.69592711 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 42.79442203 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 43.16815021 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.360044724 -5.137200000 for s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 43.91098782 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 43.67548593 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 43.30642679 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 43.87528939 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 44.23330577 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 43.77006041 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 43.23560321 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 44.04715449 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 43.02843113 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.427731041 -5.137200000 for s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 43.37385091 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 42.91977425 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 43.34982798 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 43.13002803 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 42.88230050 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 43.53835608 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 43.52047358 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 43.97500948 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 42.30622850 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 43.57454600 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 43.33406097 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 43.16232972 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 43.79407825 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.162902174 -5.137200000 for s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 43.81694601 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.546953903 -5.137200000 for s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 43.52162648 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 43.49736029 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 44.19926878 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 43.17866320 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 43.10619030 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 43.40994207 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.203447772 -5.137200000 for s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 43.28682567 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 43.55860322 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 43.31698472 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 43.39376840 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.604352287 -5.137200000 for s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 42.72551127 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.157219397 -5.137200000 for s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 43.44340151 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 43.99580385 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 43.48760759 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 42.95636614 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 42.81440882 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 43.21561194 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 43.21451115 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.994953017 -5.137200000 for s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 43.11023208 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.962046231 -5.137200000 for s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 43.50765789 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 43.30114283 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 43.80645567 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 43.06473096 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.205459528 -5.137200000 for s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 43.21579928 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 43.94530570 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 43.68839721 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.180921131 -5.137200000 for s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 43.63751277 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 43.71491531 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 44.50342853 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 44.22058848 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 44.19750121 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 43.65523273 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 43.64129165 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 44.12083683 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 43.72961436 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 43.87597395 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 42.82548973 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 43.45564594 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 43.94300880 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.294065357 -5.137200000 for s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 43.72612431 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 43.72184189 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 44.07475211 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 43.93484754 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 44.23304724 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 44.07502381 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.766294988 -5.137200000 for s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 44.18299285 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 43.55607037 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.359601562 -5.137200000 for s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 43.79845680 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 43.60894722 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 43.04215971 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 43.21679108 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 43.55655976 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 43.34733515 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 43.82248542 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 42.30063142 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 43.26281938 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 42.89938281 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 43.49181919 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 43.23128143 Required : 66.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 43.37351003 Required : 66.00000000 Info(elk): current task : 195 Info(sfacrho): density structure factors written to SFACRHO.OUT Energy window : -1000000.000 1000000.000 Info(elk): current task : 196 Info(sfacmag): magnetic structure factors written to SFACMAG_j.OUT for magnetic components j = 1 (this corresponds to the z-component of the magnetisation) Energy window : -1000000.000 1000000.000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -2462.70061065 TEST_000.OUT : -2477.68659319 absolute difference : 14.9859825400 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.246270061065E-01 Running test in directory test_022... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff97236873 in ??? #1 0x7fff97237f43 in ??? #2 0x7fff972399eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.3297 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.036711134 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 27.38528980 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.307033625 -4.590500000 for s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 26.00221661 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -10.95007366 -4.590500000 for s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 24.54508616 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -11.72083088 -4.590500000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 24.07630805 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -10.08859380 -4.590500000 for s.c. loop 5 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 26.91714561 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 23.83132337 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 19.66652494 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 19.58507318 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 19.55339657 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 19.61285628 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 19.33759174 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 19.59329325 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 18.98123442 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.894783464 -4.590500000 for s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 18.29849257 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 18.39193899 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 20.58053141 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 20.57285377 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 20.45381741 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 20.57208910 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 20.60575181 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 20.51559476 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 20.52078205 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 20.59566384 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 20.44629015 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 20.45735136 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 20.56138213 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 20.43556906 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 20.42794120 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 20.42215229 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 20.28842639 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 20.51322549 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 20.17942482 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 20.33554260 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 20.21738310 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 20.08695146 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 20.26460372 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 20.20684048 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 20.06750624 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 19.39570850 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 20.24290077 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 19.31739723 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 20.01730387 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 20.03216633 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 20.03122673 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 19.99727082 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 20.02248415 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 20.11612382 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 18.76481459 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 18.57174985 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 18.39152371 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 20.28813112 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 20.41242170 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 20.18913489 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 20.21538073 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 20.18491002 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 20.23048857 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 20.21248228 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 20.16964585 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 20.15959125 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 20.00013990 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 19.58260518 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 19.92247459 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 19.88955086 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 20.14672395 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 20.61165773 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 20.51330849 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 20.02955598 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 20.45784653 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 19.35493514 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 20.25904960 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 20.30738932 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 20.46665900 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 20.42505983 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 20.30120424 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 19.62066205 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 19.94595864 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 19.94780570 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 20.00208974 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 19.79766473 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 19.50512954 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 20.18024621 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 19.97458016 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 20.13278435 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 20.62452310 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 20.25357983 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 20.38529296 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 20.20610461 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 20.54326724 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 20.55623035 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 20.50645118 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 20.13049655 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 20.50599096 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 20.15232975 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 20.58715651 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 20.17255030 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 20.12745680 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 20.16418266 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 20.42973836 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 20.16667105 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 20.18823169 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 20.58419097 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 19.89742074 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 20.04418403 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 20.54695451 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 20.01518018 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 20.49523008 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 20.63342470 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 20.59344278 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 20.61093082 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 20.31551174 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 20.58357494 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 20.72568434 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 20.53245925 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 20.47386960 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 20.62005217 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 20.61460746 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 20.01102329 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 20.01381191 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 20.29285600 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 20.33712448 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 20.55001958 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 20.65676963 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 20.63247445 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 20.15618762 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 20.32156896 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 20.69733602 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 19.82602514 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 20.49986230 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 20.70719407 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 20.33206505 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 20.21890288 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 20.42667599 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 20.38608272 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 20.41969327 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 20.39165979 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 20.33773128 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 20.02167799 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 20.58615112 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 20.24258454 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 20.50060677 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 20.10464748 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 20.29527872 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 19.69512530 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 19.52445937 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 19.43886292 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 19.49939929 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 19.36287029 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 19.39275330 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 19.22638907 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 19.31183288 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 19.25488967 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 19.42536234 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 19.23341969 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 19.84684518 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 19.80842074 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 19.92898406 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 20.19237209 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 20.30586130 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 20.35313070 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 20.37831990 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 20.53741049 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 20.43553259 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 20.50560473 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 20.62578411 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 20.43301850 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 19.95959166 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 20.46685570 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 20.16590373 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 20.05541422 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 20.12963979 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 19.94122493 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 19.87475685 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 20.00447874 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 19.80757502 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 19.86778290 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 19.60376162 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 19.55961870 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 19.31143044 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 19.36765079 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 19.73819141 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 20.38113537 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 20.40245468 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 20.21837576 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 20.27162316 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 20.46379494 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 20.08794769 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 20.28322381 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 20.03904284 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 19.99733540 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 19.91431134 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 20.09147239 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 20.39734666 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 20.36964214 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 20.35629311 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 20.41875982 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 20.38121140 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 20.39602831 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 20.30551501 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 20.52591833 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 20.50285004 Required : 28.00000000 Info(elk): current task : 330 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Info(tddftsplr): 1 of 1000 k-points Info(tddftsplr): 501 of 1000 k-points Info(tddftsplr): 2 of 1000 k-points Info(tddftsplr): 502 of 1000 k-points Info(tddftsplr): 503 of 1000 k-points Info(tddftsplr): 3 of 1000 k-points Info(tddftsplr): 504 of 1000 k-points Info(tddftsplr): 4 of 1000 k-points Info(tddftsplr): 505 of 1000 k-points Info(tddftsplr): 5 of 1000 k-points Info(tddftsplr): 506 of 1000 k-points Info(tddftsplr): 6 of 1000 k-points Info(tddftsplr): 507 of 1000 k-points Info(tddftsplr): 7 of 1000 k-points Info(tddftsplr): 508 of 1000 k-points Info(tddftsplr): 8 of 1000 k-points Info(tddftsplr): 509 of 1000 k-points Info(tddftsplr): 9 of 1000 k-points Info(tddftsplr): 510 of 1000 k-points Info(tddftsplr): 10 of 1000 k-points Info(tddftsplr): 511 of 1000 k-points Info(tddftsplr): 11 of 1000 k-points Info(tddftsplr): 12 of 1000 k-points Info(tddftsplr): 512 of 1000 k-points Info(tddftsplr): 13 of 1000 k-points Info(tddftsplr): 513 of 1000 k-points Info(tddftsplr): 14 of 1000 k-points Info(tddftsplr): 514 of 1000 k-points Info(tddftsplr): 15 of 1000 k-points Info(tddftsplr): 515 of 1000 k-points Info(tddftsplr): 16 of 1000 k-points Info(tddftsplr): 516 of 1000 k-points Info(tddftsplr): 17 of 1000 k-points Info(tddftsplr): 517 of 1000 k-points Info(tddftsplr): 18 of 1000 k-points Info(tddftsplr): 518 of 1000 k-points Info(tddftsplr): 19 of 1000 k-points Info(tddftsplr): 519 of 1000 k-points Info(tddftsplr): 20 of 1000 k-points Info(tddftsplr): 520 of 1000 k-points Info(tddftsplr): 21 of 1000 k-points Info(tddftsplr): 521 of 1000 k-points Info(tddftsplr): 522 of 1000 k-points Info(tddftsplr): 22 of 1000 k-points Info(tddftsplr): 523 of 1000 k-points Info(tddftsplr): 524 of 1000 k-points Info(tddftsplr): 23 of 1000 k-points Info(tddftsplr): 525 of 1000 k-points Info(tddftsplr): 24 of 1000 k-points Info(tddftsplr): 526 of 1000 k-points Info(tddftsplr): 25 of 1000 k-points Info(tddftsplr): 26 of 1000 k-points Info(tddftsplr): 527 of 1000 k-points Info(tddftsplr): 27 of 1000 k-points Info(tddftsplr): 528 of 1000 k-points Info(tddftsplr): 28 of 1000 k-points Info(tddftsplr): 529 of 1000 k-points Info(tddftsplr): 29 of 1000 k-points Info(tddftsplr): 530 of 1000 k-points Info(tddftsplr): 30 of 1000 k-points Info(tddftsplr): 531 of 1000 k-points Info(tddftsplr): 31 of 1000 k-points Info(tddftsplr): 32 of 1000 k-points Info(tddftsplr): 532 of 1000 k-points Info(tddftsplr): 33 of 1000 k-points Info(tddftsplr): 533 of 1000 k-points Info(tddftsplr): 34 of 1000 k-points Info(tddftsplr): 35 of 1000 k-points Info(tddftsplr): 534 of 1000 k-points Info(tddftsplr): 36 of 1000 k-points Info(tddftsplr): 535 of 1000 k-points Info(tddftsplr): 37 of 1000 k-points Info(tddftsplr): 38 of 1000 k-points Info(tddftsplr): 536 of 1000 k-points Info(tddftsplr): 39 of 1000 k-points Info(tddftsplr): 537 of 1000 k-points Info(tddftsplr): 40 of 1000 k-points Info(tddftsplr): 538 of 1000 k-points Info(tddftsplr): 41 of 1000 k-points Info(tddftsplr): 42 of 1000 k-points Info(tddftsplr): 539 of 1000 k-points Info(tddftsplr): 43 of 1000 k-points Info(tddftsplr): 540 of 1000 k-points Info(tddftsplr): 44 of 1000 k-points Info(tddftsplr): 45 of 1000 k-points Info(tddftsplr): 541 of 1000 k-points Info(tddftsplr): 46 of 1000 k-points Info(tddftsplr): 542 of 1000 k-points Info(tddftsplr): 47 of 1000 k-points Info(tddftsplr): 543 of 1000 k-points Info(tddftsplr): 48 of 1000 k-points Info(tddftsplr): 544 of 1000 k-points Info(tddftsplr): 49 of 1000 k-points Info(tddftsplr): 545 of 1000 k-points Info(tddftsplr): 50 of 1000 k-points Info(tddftsplr): 546 of 1000 k-points Info(tddftsplr): 51 of 1000 k-points Info(tddftsplr): 547 of 1000 k-points Info(tddftsplr): 52 of 1000 k-points Info(tddftsplr): 548 of 1000 k-points Info(tddftsplr): 53 of 1000 k-points Info(tddftsplr): 549 of 1000 k-points Info(tddftsplr): 54 of 1000 k-points Info(tddftsplr): 550 of 1000 k-points Info(tddftsplr): 55 of 1000 k-points Info(tddftsplr): 551 of 1000 k-points Info(tddftsplr): 56 of 1000 k-points Info(tddftsplr): 552 of 1000 k-points Info(tddftsplr): 57 of 1000 k-points Info(tddftsplr): 553 of 1000 k-points Info(tddftsplr): 58 of 1000 k-points Info(tddftsplr): 554 of 1000 k-points Info(tddftsplr): 59 of 1000 k-points Info(tddftsplr): 555 of 1000 k-points Info(tddftsplr): 556 of 1000 k-points Info(tddftsplr): 60 of 1000 k-points Info(tddftsplr): 557 of 1000 k-points Info(tddftsplr): 61 of 1000 k-points Info(tddftsplr): 558 of 1000 k-points Info(tddftsplr): 62 of 1000 k-points Info(tddftsplr): 559 of 1000 k-points Info(tddftsplr): 63 of 1000 k-points Info(tddftsplr): 560 of 1000 k-points Info(tddftsplr): 64 of 1000 k-points Info(tddftsplr): 561 of 1000 k-points Info(tddftsplr): 65 of 1000 k-points Info(tddftsplr): 66 of 1000 k-points Info(tddftsplr): 562 of 1000 k-points Info(tddftsplr): 67 of 1000 k-points Info(tddftsplr): 563 of 1000 k-points Info(tddftsplr): 68 of 1000 k-points Info(tddftsplr): 564 of 1000 k-points Info(tddftsplr): 69 of 1000 k-points Info(tddftsplr): 70 of 1000 k-points Info(tddftsplr): 565 of 1000 k-points Info(tddftsplr): 71 of 1000 k-points Info(tddftsplr): 566 of 1000 k-points Info(tddftsplr): 567 of 1000 k-points Info(tddftsplr): 72 of 1000 k-points Info(tddftsplr): 568 of 1000 k-points Info(tddftsplr): 73 of 1000 k-points Info(tddftsplr): 569 of 1000 k-points Info(tddftsplr): 570 of 1000 k-points Info(tddftsplr): 74 of 1000 k-points Info(tddftsplr): 571 of 1000 k-points Info(tddftsplr): 572 of 1000 k-points Info(tddftsplr): 75 of 1000 k-points Info(tddftsplr): 76 of 1000 k-points Info(tddftsplr): 573 of 1000 k-points Info(tddftsplr): 77 of 1000 k-points Info(tddftsplr): 574 of 1000 k-points Info(tddftsplr): 78 of 1000 k-points Info(tddftsplr): 575 of 1000 k-points Info(tddftsplr): 79 of 1000 k-points Info(tddftsplr): 576 of 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Info(tddftsplr): 809 of 1000 k-points Info(tddftsplr): 343 of 1000 k-points Info(tddftsplr): 810 of 1000 k-points Info(tddftsplr): 344 of 1000 k-points Info(tddftsplr): 345 of 1000 k-points Info(tddftsplr): 811 of 1000 k-points Info(tddftsplr): 346 of 1000 k-points Info(tddftsplr): 812 of 1000 k-points Info(tddftsplr): 347 of 1000 k-points Info(tddftsplr): 813 of 1000 k-points Info(tddftsplr): 348 of 1000 k-points Info(tddftsplr): 349 of 1000 k-points Info(tddftsplr): 814 of 1000 k-points Info(tddftsplr): 350 of 1000 k-points Info(tddftsplr): 815 of 1000 k-points Info(tddftsplr): 351 of 1000 k-points Info(tddftsplr): 816 of 1000 k-points Info(tddftsplr): 352 of 1000 k-points Info(tddftsplr): 353 of 1000 k-points Info(tddftsplr): 817 of 1000 k-points Info(tddftsplr): 354 of 1000 k-points Info(tddftsplr): 818 of 1000 k-points Info(tddftsplr): 355 of 1000 k-points Info(tddftsplr): 819 of 1000 k-points Info(tddftsplr): 356 of 1000 k-points Info(tddftsplr): 820 of 1000 k-points Info(tddftsplr): 357 of 1000 k-points Info(tddftsplr): 358 of 1000 k-points Info(tddftsplr): 821 of 1000 k-points Info(tddftsplr): 359 of 1000 k-points Info(tddftsplr): 822 of 1000 k-points Info(tddftsplr): 360 of 1000 k-points Info(tddftsplr): 823 of 1000 k-points Info(tddftsplr): 361 of 1000 k-points Info(tddftsplr): 824 of 1000 k-points Info(tddftsplr): 362 of 1000 k-points Info(tddftsplr): 825 of 1000 k-points Info(tddftsplr): 363 of 1000 k-points Info(tddftsplr): 364 of 1000 k-points Info(tddftsplr): 826 of 1000 k-points Info(tddftsplr): 365 of 1000 k-points Info(tddftsplr): 827 of 1000 k-points Info(tddftsplr): 366 of 1000 k-points Info(tddftsplr): 367 of 1000 k-points Info(tddftsplr): 828 of 1000 k-points Info(tddftsplr): 368 of 1000 k-points Info(tddftsplr): 369 of 1000 k-points Info(tddftsplr): 829 of 1000 k-points Info(tddftsplr): 370 of 1000 k-points Info(tddftsplr): 830 of 1000 k-points Info(tddftsplr): 371 of 1000 k-points Info(tddftsplr): 372 of 1000 k-points Info(tddftsplr): 831 of 1000 k-points Info(tddftsplr): 373 of 1000 k-points Info(tddftsplr): 374 of 1000 k-points Info(tddftsplr): 832 of 1000 k-points Info(tddftsplr): 375 of 1000 k-points Info(tddftsplr): 833 of 1000 k-points Info(tddftsplr): 376 of 1000 k-points Info(tddftsplr): 377 of 1000 k-points Info(tddftsplr): 834 of 1000 k-points Info(tddftsplr): 378 of 1000 k-points Info(tddftsplr): 835 of 1000 k-points Info(tddftsplr): 379 of 1000 k-points Info(tddftsplr): 836 of 1000 k-points Info(tddftsplr): 380 of 1000 k-points Info(tddftsplr): 837 of 1000 k-points Info(tddftsplr): 381 of 1000 k-points Info(tddftsplr): 382 of 1000 k-points Info(tddftsplr): 838 of 1000 k-points Info(tddftsplr): 383 of 1000 k-points Info(tddftsplr): 839 of 1000 k-points Info(tddftsplr): 384 of 1000 k-points Info(tddftsplr): 840 of 1000 k-points Info(tddftsplr): 841 of 1000 k-points Info(tddftsplr): 385 of 1000 k-points Info(tddftsplr): 842 of 1000 k-points Info(tddftsplr): 386 of 1000 k-points Info(tddftsplr): 387 of 1000 k-points Info(tddftsplr): 843 of 1000 k-points Info(tddftsplr): 388 of 1000 k-points Info(tddftsplr): 389 of 1000 k-points Info(tddftsplr): 844 of 1000 k-points Info(tddftsplr): 390 of 1000 k-points Info(tddftsplr): 845 of 1000 k-points Info(tddftsplr): 391 of 1000 k-points Info(tddftsplr): 392 of 1000 k-points Info(tddftsplr): 846 of 1000 k-points Info(tddftsplr): 393 of 1000 k-points Info(tddftsplr): 847 of 1000 k-points Info(tddftsplr): 394 of 1000 k-points Info(tddftsplr): 848 of 1000 k-points Info(tddftsplr): 395 of 1000 k-points Info(tddftsplr): 396 of 1000 k-points Info(tddftsplr): 849 of 1000 k-points Info(tddftsplr): 397 of 1000 k-points Info(tddftsplr): 398 of 1000 k-points Info(tddftsplr): 850 of 1000 k-points Info(tddftsplr): 399 of 1000 k-points Info(tddftsplr): 851 of 1000 k-points Info(tddftsplr): 400 of 1000 k-points Info(tddftsplr): 401 of 1000 k-points Info(tddftsplr): 852 of 1000 k-points Info(tddftsplr): 402 of 1000 k-points Info(tddftsplr): 403 of 1000 k-points Info(tddftsplr): 853 of 1000 k-points Info(tddftsplr): 404 of 1000 k-points Info(tddftsplr): 854 of 1000 k-points Info(tddftsplr): 405 of 1000 k-points Info(tddftsplr): 406 of 1000 k-points Info(tddftsplr): 855 of 1000 k-points Info(tddftsplr): 407 of 1000 k-points Info(tddftsplr): 856 of 1000 k-points Info(tddftsplr): 408 of 1000 k-points Info(tddftsplr): 409 of 1000 k-points Info(tddftsplr): 857 of 1000 k-points Info(tddftsplr): 410 of 1000 k-points Info(tddftsplr): 411 of 1000 k-points Info(tddftsplr): 858 of 1000 k-points Info(tddftsplr): 412 of 1000 k-points Info(tddftsplr): 413 of 1000 k-points Info(tddftsplr): 859 of 1000 k-points Info(tddftsplr): 414 of 1000 k-points Info(tddftsplr): 860 of 1000 k-points Info(tddftsplr): 861 of 1000 k-points Info(tddftsplr): 415 of 1000 k-points Info(tddftsplr): 416 of 1000 k-points Info(tddftsplr): 862 of 1000 k-points Info(tddftsplr): 417 of 1000 k-points Info(tddftsplr): 863 of 1000 k-points Info(tddftsplr): 418 of 1000 k-points Info(tddftsplr): 864 of 1000 k-points Info(tddftsplr): 419 of 1000 k-points Info(tddftsplr): 865 of 1000 k-points Info(tddftsplr): 420 of 1000 k-points Info(tddftsplr): 866 of 1000 k-points Info(tddftsplr): 867 of 1000 k-points Info(tddftsplr): 421 of 1000 k-points Info(tddftsplr): 422 of 1000 k-points Info(tddftsplr): 868 of 1000 k-points Info(tddftsplr): 423 of 1000 k-points Info(tddftsplr): 869 of 1000 k-points Info(tddftsplr): 424 of 1000 k-points Info(tddftsplr): 870 of 1000 k-points Info(tddftsplr): 425 of 1000 k-points Info(tddftsplr): 871 of 1000 k-points Info(tddftsplr): 426 of 1000 k-points Info(tddftsplr): 872 of 1000 k-points Info(tddftsplr): 427 of 1000 k-points Info(tddftsplr): 428 of 1000 k-points Info(tddftsplr): 873 of 1000 k-points Info(tddftsplr): 429 of 1000 k-points Info(tddftsplr): 874 of 1000 k-points Info(tddftsplr): 430 of 1000 k-points Info(tddftsplr): 431 of 1000 k-points Info(tddftsplr): 875 of 1000 k-points Info(tddftsplr): 432 of 1000 k-points Info(tddftsplr): 433 of 1000 k-points Info(tddftsplr): 876 of 1000 k-points Info(tddftsplr): 434 of 1000 k-points Info(tddftsplr): 877 of 1000 k-points Info(tddftsplr): 435 of 1000 k-points Info(tddftsplr): 878 of 1000 k-points Info(tddftsplr): 436 of 1000 k-points Info(tddftsplr): 879 of 1000 k-points Info(tddftsplr): 437 of 1000 k-points Info(tddftsplr): 438 of 1000 k-points Info(tddftsplr): 880 of 1000 k-points Info(tddftsplr): 439 of 1000 k-points Info(tddftsplr): 881 of 1000 k-points Info(tddftsplr): 440 of 1000 k-points Info(tddftsplr): 882 of 1000 k-points Info(tddftsplr): 441 of 1000 k-points Info(tddftsplr): 442 of 1000 k-points Info(tddftsplr): 883 of 1000 k-points Info(tddftsplr): 443 of 1000 k-points Info(tddftsplr): 884 of 1000 k-points Info(tddftsplr): 444 of 1000 k-points Info(tddftsplr): 885 of 1000 k-points Info(tddftsplr): 445 of 1000 k-points Info(tddftsplr): 446 of 1000 k-points Info(tddftsplr): 447 of 1000 k-points Info(tddftsplr): 886 of 1000 k-points Info(tddftsplr): 448 of 1000 k-points Info(tddftsplr): 449 of 1000 k-points Info(tddftsplr): 887 of 1000 k-points Info(tddftsplr): 450 of 1000 k-points Info(tddftsplr): 888 of 1000 k-points Info(tddftsplr): 451 of 1000 k-points Info(tddftsplr): 452 of 1000 k-points Info(tddftsplr): 889 of 1000 k-points Info(tddftsplr): 453 of 1000 k-points Info(tddftsplr): 454 of 1000 k-points Info(tddftsplr): 455 of 1000 k-points Info(tddftsplr): 890 of 1000 k-points Info(tddftsplr): 456 of 1000 k-points Info(tddftsplr): 891 of 1000 k-points Info(tddftsplr): 457 of 1000 k-points Info(tddftsplr): 458 of 1000 k-points Info(tddftsplr): 892 of 1000 k-points Info(tddftsplr): 459 of 1000 k-points Info(tddftsplr): 460 of 1000 k-points Info(tddftsplr): 893 of 1000 k-points Info(tddftsplr): 461 of 1000 k-points Info(tddftsplr): 894 of 1000 k-points Info(tddftsplr): 895 of 1000 k-points Info(tddftsplr): 462 of 1000 k-points Info(tddftsplr): 463 of 1000 k-points Info(tddftsplr): 896 of 1000 k-points Info(tddftsplr): 464 of 1000 k-points Info(tddftsplr): 897 of 1000 k-points Info(tddftsplr): 465 of 1000 k-points Info(tddftsplr): 898 of 1000 k-points Info(tddftsplr): 899 of 1000 k-points Info(tddftsplr): 466 of 1000 k-points Info(tddftsplr): 900 of 1000 k-points Info(tddftsplr): 467 of 1000 k-points Info(tddftsplr): 468 of 1000 k-points Info(tddftsplr): 901 of 1000 k-points Info(tddftsplr): 469 of 1000 k-points Info(tddftsplr): 902 of 1000 k-points Info(tddftsplr): 470 of 1000 k-points Info(tddftsplr): 903 of 1000 k-points Info(tddftsplr): 471 of 1000 k-points Info(tddftsplr): 904 of 1000 k-points Info(tddftsplr): 472 of 1000 k-points Info(tddftsplr): 473 of 1000 k-points Info(tddftsplr): 474 of 1000 k-points Info(tddftsplr): 905 of 1000 k-points Info(tddftsplr): 475 of 1000 k-points Info(tddftsplr): 476 of 1000 k-points Info(tddftsplr): 906 of 1000 k-points Info(tddftsplr): 477 of 1000 k-points Info(tddftsplr): 907 of 1000 k-points Info(tddftsplr): 478 of 1000 k-points Info(tddftsplr): 908 of 1000 k-points Info(tddftsplr): 479 of 1000 k-points Info(tddftsplr): 909 of 1000 k-points Info(tddftsplr): 480 of 1000 k-points Info(tddftsplr): 910 of 1000 k-points Info(tddftsplr): 481 of 1000 k-points Info(tddftsplr): 482 of 1000 k-points Info(tddftsplr): 911 of 1000 k-points Info(tddftsplr): 483 of 1000 k-points Info(tddftsplr): 912 of 1000 k-points Info(tddftsplr): 484 of 1000 k-points Info(tddftsplr): 913 of 1000 k-points Info(tddftsplr): 485 of 1000 k-points Info(tddftsplr): 914 of 1000 k-points Info(tddftsplr): 486 of 1000 k-points Info(tddftsplr): 487 of 1000 k-points Info(tddftsplr): 915 of 1000 k-points Info(tddftsplr): 488 of 1000 k-points Info(tddftsplr): 916 of 1000 k-points Info(tddftsplr): 489 of 1000 k-points Info(tddftsplr): 917 of 1000 k-points Info(tddftsplr): 490 of 1000 k-points Info(tddftsplr): 918 of 1000 k-points Info(tddftsplr): 491 of 1000 k-points Info(tddftsplr): 919 of 1000 k-points Info(tddftsplr): 492 of 1000 k-points Info(tddftsplr): 920 of 1000 k-points Info(tddftsplr): 493 of 1000 k-points Info(tddftsplr): 494 of 1000 k-points Info(tddftsplr): 921 of 1000 k-points Info(tddftsplr): 495 of 1000 k-points Info(tddftsplr): 922 of 1000 k-points Info(tddftsplr): 496 of 1000 k-points Info(tddftsplr): 923 of 1000 k-points Info(tddftsplr): 497 of 1000 k-points Info(tddftsplr): 924 of 1000 k-points Info(tddftsplr): 498 of 1000 k-points Info(tddftsplr): 925 of 1000 k-points Info(tddftsplr): 499 of 1000 k-points Info(tddftsplr): 926 of 1000 k-points Info(tddftsplr): 500 of 1000 k-points Info(tddftsplr): 927 of 1000 k-points Info(tddftsplr): 928 of 1000 k-points Info(tddftsplr): 929 of 1000 k-points Info(tddftsplr): 930 of 1000 k-points Info(tddftsplr): 931 of 1000 k-points Info(tddftsplr): 932 of 1000 k-points Info(tddftsplr): 933 of 1000 k-points Info(tddftsplr): 934 of 1000 k-points Info(tddftsplr): 935 of 1000 k-points Info(tddftsplr): 936 of 1000 k-points Info(tddftsplr): 937 of 1000 k-points Info(tddftsplr): 938 of 1000 k-points Info(tddftsplr): 939 of 1000 k-points Info(tddftsplr): 940 of 1000 k-points Info(tddftsplr): 941 of 1000 k-points Info(tddftsplr): 942 of 1000 k-points Info(tddftsplr): 943 of 1000 k-points Info(tddftsplr): 944 of 1000 k-points Info(tddftsplr): 945 of 1000 k-points Info(tddftsplr): 946 of 1000 k-points Info(tddftsplr): 947 of 1000 k-points Info(tddftsplr): 948 of 1000 k-points Info(tddftsplr): 949 of 1000 k-points Info(tddftsplr): 950 of 1000 k-points Info(tddftsplr): 951 of 1000 k-points Info(tddftsplr): 952 of 1000 k-points Info(tddftsplr): 953 of 1000 k-points Info(tddftsplr): 954 of 1000 k-points Info(tddftsplr): 955 of 1000 k-points Info(tddftsplr): 956 of 1000 k-points Info(tddftsplr): 957 of 1000 k-points Info(tddftsplr): 958 of 1000 k-points Info(tddftsplr): 959 of 1000 k-points Info(tddftsplr): 960 of 1000 k-points Info(tddftsplr): 961 of 1000 k-points Info(tddftsplr): 962 of 1000 k-points Info(tddftsplr): 963 of 1000 k-points Info(tddftsplr): 964 of 1000 k-points Info(tddftsplr): 965 of 1000 k-points Info(tddftsplr): 966 of 1000 k-points Info(tddftsplr): 967 of 1000 k-points Info(tddftsplr): 968 of 1000 k-points Info(tddftsplr): 969 of 1000 k-points Info(tddftsplr): 970 of 1000 k-points Info(tddftsplr): 971 of 1000 k-points Info(tddftsplr): 972 of 1000 k-points Info(tddftsplr): 973 of 1000 k-points Info(tddftsplr): 974 of 1000 k-points Info(tddftsplr): 975 of 1000 k-points Info(tddftsplr): 976 of 1000 k-points Info(tddftsplr): 977 of 1000 k-points Info(tddftsplr): 978 of 1000 k-points Info(tddftsplr): 979 of 1000 k-points Info(tddftsplr): 980 of 1000 k-points Info(tddftsplr): 981 of 1000 k-points Info(tddftsplr): 982 of 1000 k-points Info(tddftsplr): 983 of 1000 k-points Info(tddftsplr): 984 of 1000 k-points Info(tddftsplr): 985 of 1000 k-points Info(tddftsplr): 986 of 1000 k-points Info(tddftsplr): 987 of 1000 k-points Info(tddftsplr): 988 of 1000 k-points Info(tddftsplr): 989 of 1000 k-points Info(tddftsplr): 990 of 1000 k-points Info(tddftsplr): 991 of 1000 k-points Info(tddftsplr): 992 of 1000 k-points Info(tddftsplr): 993 of 1000 k-points Info(tddftsplr): 994 of 1000 k-points Info(tddftsplr): 995 of 1000 k-points Info(tddftsplr): 996 of 1000 k-points Info(tddftsplr): 997 of 1000 k-points Info(tddftsplr): 998 of 1000 k-points Info(tddftsplr): 999 of 1000 k-points Info(tddftsplr): 1000 of 1000 k-points Info(tddftsplr): Spin-dependent response function chi_ij(G,G',q,w) written to CHI_ij.OUT for i,j = 0-3; G = G' = 0; and all wplot frequencies q-vector (lattice coordinates) : 0.1000000000 0.3000000000 0.000000000 q-vector length : 0.4621801190 The elements of chi labeled by (i,j) form the 4x4 matrix : (_|_ _ _) chi(G,G',q,w) = ( | ) ( | ) ( | ) (0,0) is the charge-charge response drho/dv (0,1-3) is the charge-magnetisation response drho/dB (1-3,0) is the magnetisation-charge response dm/v (1-3,1-3) is the magnetisation-magnetisation response dm/dB Non-interacting Kohn-Sham reponse function written to CHI0_ij.OUT Transverse components corresponding to m_+- = m_x +- im_y written to CHI_T.OUT and CHI0_T.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1518.39249411 TEST_000.OUT : -1467.49330914 absolute difference : 50.8991849700 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.151839249411E-01 Running test in directory test_023... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Li) from 1.8000 to 1.7782 Info(checkmt): reduced muffin-tin radius of species 2 (F) from 2.0000 to 1.9758 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 7.552032258 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 7.387103533 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 7.476001250 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 7.730315142 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 8.360520001 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 8.719996730 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 8.293528372 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 8.105579466 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 7.147305998 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 6.809689690 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 6.355893337 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 6.202073887 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 6.243789825 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 6.037702795 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 5.940899060 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 6.301868343 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 5.956853656 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 6.016796239 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 5.954599481 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 6.049388667 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 6.016291485 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 6.004446075 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 6.071319315 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 6.082674902 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 6.129577382 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 5.935488631 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 5.955047193 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 5.995108354 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 6.122258428 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 6.168521245 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 6.150715718 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 6.154970875 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 6.047101277 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 6.110580574 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 6.039164242 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 6.144130933 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 5.996415466 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 5.945255510 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 5.989032144 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 5.991234453 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 6.082363382 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 5.963091607 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 6.017911716 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 6.035689153 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 6.054569962 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 6.177851125 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 5.888513397 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 6.042505239 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 6.277125100 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 6.063590848 Required : 12.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -3.916105349 -3.878400000 for s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 6.062146211 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 6.102986953 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 6.124687832 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 6.145798388 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 6.040659756 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 6.023053401 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 5.888528894 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 6.057555682 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 5.961220881 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 6.072137578 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 6.211157652 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 6.120737255 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 6.101094058 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 5.980987916 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 6.306542521 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 6.393136212 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 6.349109953 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 6.246331844 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 6.218567194 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 6.192167221 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 6.210522520 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 6.118421476 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 6.138039606 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 5.891302245 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 6.152355249 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 6.155681735 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 6.215152204 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 6.111362311 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 6.294942512 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 6.186077133 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 6.215460247 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 6.193133805 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 6.109294453 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 6.147534042 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 6.152548307 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 5.981135327 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 6.170360367 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 6.033600674 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 5.998556859 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 6.256504135 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 6.153774169 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 6.090905000 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 6.258633026 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 6.156022515 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 6.124902008 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 6.229986870 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 6.250389280 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 6.127345090 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 6.289063570 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 6.350429899 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 6.296628232 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 6.277029426 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 6.291968967 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 6.274228775 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 6.284477411 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 6.146783263 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 6.207234008 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 6.239321143 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 6.302171818 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 6.153256363 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 6.184185668 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 6.201063725 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 6.032392990 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 6.231710249 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 6.120487483 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 6.171345173 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 6.154959514 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 6.186317596 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 5.978655165 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 6.120041588 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 6.048330909 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 6.076353264 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 6.046564028 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 6.344697527 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 6.102415981 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 6.182255825 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 6.156670086 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 6.199411771 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 6.037059785 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 6.001814206 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 6.083957147 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 5.941852994 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 6.004207632 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 6.028229742 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 5.998764377 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 6.366530706 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 6.174387595 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 6.018429185 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 6.103607326 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 6.049538984 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 6.101958096 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 5.993697836 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 6.125213159 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 6.174432128 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 6.028375958 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 6.044150907 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 6.086242786 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 6.030752259 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 6.152475580 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 6.093813773 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 6.174208024 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 5.967373873 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 5.918012765 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 5.913992670 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 6.114807175 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 6.150327875 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 6.149898746 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 6.071966733 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 6.120678781 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 6.047128497 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 6.149148246 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 6.010482906 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 6.135658055 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 6.199840229 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 6.200076007 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 6.211420150 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 5.839744506 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 6.063377637 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 5.928628802 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 5.925059254 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 6.153932729 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 6.337184048 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 6.186744514 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 6.274765577 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 6.234721294 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 6.343979454 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 6.400573978 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 6.415854336 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 6.333706748 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 6.234373595 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 6.099018379 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 6.305575369 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 6.273812156 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 6.346640629 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 6.123233875 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 6.285155105 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 6.256961214 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 6.110250916 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 5.960486790 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 6.082207562 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 5.984158346 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 6.094381175 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 6.117840249 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 5.967209364 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 6.095892004 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 5.987460207 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 6.011922356 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 6.095314386 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 6.200484600 Required : 12.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 6.191500645 Required : 12.00000000 Info(elk): current task : 120 Info(genpmat): 1 of 29 k-points Info(genpmat): 16 of 29 k-points Info(genpmat): 2 of 29 k-points Info(genpmat): 17 of 29 k-points Info(genpmat): 3 of 29 k-points Info(genpmat): 18 of 29 k-points Info(genpmat): 4 of 29 k-points Info(genpmat): 19 of 29 k-points Info(genpmat): 5 of 29 k-points Info(genpmat): 20 of 29 k-points Info(genpmat): 6 of 29 k-points Info(genpmat): 21 of 29 k-points Info(genpmat): 7 of 29 k-points Info(genpmat): 22 of 29 k-points Info(genpmat): 8 of 29 k-points Info(genpmat): 23 of 29 k-points Info(genpmat): 24 of 29 k-points Info(genpmat): 9 of 29 k-points Info(genpmat): 10 of 29 k-points Info(genpmat): 25 of 29 k-points Info(genpmat): 26 of 29 k-points Info(genpmat): 11 of 29 k-points Info(genpmat): 27 of 29 k-points Info(genpmat): 12 of 29 k-points Info(genpmat): 28 of 29 k-points Info(genpmat): 13 of 29 k-points Info(genpmat): 14 of 29 k-points Info(genpmat): 29 of 29 k-points Info(genpmat): 15 of 29 k-points Info(writepmat): momentum matrix elements written to file PMAT.OUT Info(elk): current task : 121 Info(dielectric): dielectric tensor written to EPSILON_ij.OUT optical conductivity written to SIGMA_ij.OUT for components i = 1, j = 1 Info(elk): current task : 125 Info(nonlinopt): 257 of 512 k-points Info(nonlinopt): 1 of 512 k-points Info(nonlinopt): 258 of 512 k-points Info(nonlinopt): 2 of 512 k-points Info(nonlinopt): 259 of 512 k-points Info(nonlinopt): 3 of 512 k-points Info(nonlinopt): 4 of 512 k-points Info(nonlinopt): 260 of 512 k-points Info(nonlinopt): 5 of 512 k-points Info(nonlinopt): 6 of 512 k-points Info(nonlinopt): 261 of 512 k-points Info(nonlinopt): 7 of 512 k-points Info(nonlinopt): 8 of 512 k-points Info(nonlinopt): 262 of 512 k-points Info(nonlinopt): 9 of 512 k-points Info(nonlinopt): 10 of 512 k-points Info(nonlinopt): 263 of 512 k-points Info(nonlinopt): 11 of 512 k-points Info(nonlinopt): 12 of 512 k-points Info(nonlinopt): 264 of 512 k-points Info(nonlinopt): 13 of 512 k-points Info(nonlinopt): 265 of 512 k-points Info(nonlinopt): 266 of 512 k-points Info(nonlinopt): 14 of 512 k-points Info(nonlinopt): 267 of 512 k-points Info(nonlinopt): 268 of 512 k-points Info(nonlinopt): 15 of 512 k-points Info(nonlinopt): 269 of 512 k-points Info(nonlinopt): 16 of 512 k-points Info(nonlinopt): 270 of 512 k-points Info(nonlinopt): 17 of 512 k-points Info(nonlinopt): 18 of 512 k-points Info(nonlinopt): 271 of 512 k-points Info(nonlinopt): 272 of 512 k-points Info(nonlinopt): 19 of 512 k-points Info(nonlinopt): 273 of 512 k-points Info(nonlinopt): 20 of 512 k-points Info(nonlinopt): 274 of 512 k-points Info(nonlinopt): 21 of 512 k-points Info(nonlinopt): 22 of 512 k-points Info(nonlinopt): 275 of 512 k-points Info(nonlinopt): 23 of 512 k-points Info(nonlinopt): 276 of 512 k-points Info(nonlinopt): 24 of 512 k-points Info(nonlinopt): 277 of 512 k-points Info(nonlinopt): 25 of 512 k-points Info(nonlinopt): 278 of 512 k-points Info(nonlinopt): 26 of 512 k-points Info(nonlinopt): 279 of 512 k-points Info(nonlinopt): 27 of 512 k-points Info(nonlinopt): 280 of 512 k-points Info(nonlinopt): 28 of 512 k-points Info(nonlinopt): 29 of 512 k-points Info(nonlinopt): 281 of 512 k-points Info(nonlinopt): 282 of 512 k-points Info(nonlinopt): 30 of 512 k-points Info(nonlinopt): 283 of 512 k-points Info(nonlinopt): 284 of 512 k-points Info(nonlinopt): 31 of 512 k-points Info(nonlinopt): 285 of 512 k-points Info(nonlinopt): 286 of 512 k-points Info(nonlinopt): 287 of 512 k-points Info(nonlinopt): 32 of 512 k-points Info(nonlinopt): 288 of 512 k-points Info(nonlinopt): 33 of 512 k-points Info(nonlinopt): 34 of 512 k-points Info(nonlinopt): 289 of 512 k-points Info(nonlinopt): 35 of 512 k-points Info(nonlinopt): 290 of 512 k-points Info(nonlinopt): 36 of 512 k-points Info(nonlinopt): 37 of 512 k-points Info(nonlinopt): 291 of 512 k-points Info(nonlinopt): 38 of 512 k-points Info(nonlinopt): 292 of 512 k-points Info(nonlinopt): 293 of 512 k-points Info(nonlinopt): 39 of 512 k-points Info(nonlinopt): 294 of 512 k-points Info(nonlinopt): 295 of 512 k-points Info(nonlinopt): 40 of 512 k-points Info(nonlinopt): 296 of 512 k-points Info(nonlinopt): 297 of 512 k-points Info(nonlinopt): 41 of 512 k-points Info(nonlinopt): 298 of 512 k-points Info(nonlinopt): 299 of 512 k-points Info(nonlinopt): 42 of 512 k-points Info(nonlinopt): 300 of 512 k-points Info(nonlinopt): 43 of 512 k-points Info(nonlinopt): 301 of 512 k-points Info(nonlinopt): 44 of 512 k-points Info(nonlinopt): 45 of 512 k-points Info(nonlinopt): 302 of 512 k-points Info(nonlinopt): 46 of 512 k-points Info(nonlinopt): 303 of 512 k-points Info(nonlinopt): 304 of 512 k-points Info(nonlinopt): 305 of 512 k-points Info(nonlinopt): 47 of 512 k-points Info(nonlinopt): 306 of 512 k-points Info(nonlinopt): 48 of 512 k-points Info(nonlinopt): 307 of 512 k-points Info(nonlinopt): 308 of 512 k-points Info(nonlinopt): 49 of 512 k-points Info(nonlinopt): 309 of 512 k-points Info(nonlinopt): 50 of 512 k-points Info(nonlinopt): 310 of 512 k-points Info(nonlinopt): 311 of 512 k-points Info(nonlinopt): 51 of 512 k-points Info(nonlinopt): 52 of 512 k-points Info(nonlinopt): 312 of 512 k-points Info(nonlinopt): 53 of 512 k-points Info(nonlinopt): 313 of 512 k-points Info(nonlinopt): 54 of 512 k-points Info(nonlinopt): 314 of 512 k-points Info(nonlinopt): 55 of 512 k-points Info(nonlinopt): 315 of 512 k-points Info(nonlinopt): 56 of 512 k-points Info(nonlinopt): 316 of 512 k-points Info(nonlinopt): 57 of 512 k-points Info(nonlinopt): 317 of 512 k-points Info(nonlinopt): 58 of 512 k-points Info(nonlinopt): 318 of 512 k-points Info(nonlinopt): 59 of 512 k-points Info(nonlinopt): 319 of 512 k-points Info(nonlinopt): 60 of 512 k-points Info(nonlinopt): 320 of 512 k-points Info(nonlinopt): 61 of 512 k-points Info(nonlinopt): 321 of 512 k-points Info(nonlinopt): 62 of 512 k-points Info(nonlinopt): 322 of 512 k-points Info(nonlinopt): 63 of 512 k-points Info(nonlinopt): 323 of 512 k-points Info(nonlinopt): 324 of 512 k-points Info(nonlinopt): 64 of 512 k-points Info(nonlinopt): 65 of 512 k-points Info(nonlinopt): 325 of 512 k-points Info(nonlinopt): 66 of 512 k-points Info(nonlinopt): 67 of 512 k-points Info(nonlinopt): 326 of 512 k-points Info(nonlinopt): 68 of 512 k-points Info(nonlinopt): 327 of 512 k-points Info(nonlinopt): 69 of 512 k-points Info(nonlinopt): 328 of 512 k-points Info(nonlinopt): 70 of 512 k-points Info(nonlinopt): 329 of 512 k-points Info(nonlinopt): 71 of 512 k-points Info(nonlinopt): 330 of 512 k-points Info(nonlinopt): 72 of 512 k-points Info(nonlinopt): 331 of 512 k-points Info(nonlinopt): 73 of 512 k-points Info(nonlinopt): 332 of 512 k-points Info(nonlinopt): 74 of 512 k-points Info(nonlinopt): 333 of 512 k-points Info(nonlinopt): 75 of 512 k-points Info(nonlinopt): 334 of 512 k-points Info(nonlinopt): 76 of 512 k-points Info(nonlinopt): 335 of 512 k-points Info(nonlinopt): 77 of 512 k-points Info(nonlinopt): 78 of 512 k-points Info(nonlinopt): 336 of 512 k-points Info(nonlinopt): 337 of 512 k-points Info(nonlinopt): 79 of 512 k-points Info(nonlinopt): 338 of 512 k-points Info(nonlinopt): 80 of 512 k-points Info(nonlinopt): 339 of 512 k-points Info(nonlinopt): 81 of 512 k-points Info(nonlinopt): 340 of 512 k-points Info(nonlinopt): 82 of 512 k-points Info(nonlinopt): 341 of 512 k-points Info(nonlinopt): 342 of 512 k-points Info(nonlinopt): 83 of 512 k-points Info(nonlinopt): 343 of 512 k-points Info(nonlinopt): 84 of 512 k-points Info(nonlinopt): 344 of 512 k-points Info(nonlinopt): 85 of 512 k-points Info(nonlinopt): 86 of 512 k-points Info(nonlinopt): 345 of 512 k-points Info(nonlinopt): 87 of 512 k-points Info(nonlinopt): 346 of 512 k-points Info(nonlinopt): 347 of 512 k-points Info(nonlinopt): 88 of 512 k-points Info(nonlinopt): 348 of 512 k-points Info(nonlinopt): 89 of 512 k-points Info(nonlinopt): 90 of 512 k-points Info(nonlinopt): 349 of 512 k-points Info(nonlinopt): 350 of 512 k-points Info(nonlinopt): 91 of 512 k-points Info(nonlinopt): 92 of 512 k-points Info(nonlinopt): 351 of 512 k-points Info(nonlinopt): 93 of 512 k-points Info(nonlinopt): 94 of 512 k-points Info(nonlinopt): 352 of 512 k-points Info(nonlinopt): 95 of 512 k-points Info(nonlinopt): 96 of 512 k-points Info(nonlinopt): 353 of 512 k-points Info(nonlinopt): 97 of 512 k-points Info(nonlinopt): 98 of 512 k-points Info(nonlinopt): 354 of 512 k-points Info(nonlinopt): 355 of 512 k-points Info(nonlinopt): 99 of 512 k-points Info(nonlinopt): 356 of 512 k-points Info(nonlinopt): 357 of 512 k-points Info(nonlinopt): 100 of 512 k-points Info(nonlinopt): 358 of 512 k-points Info(nonlinopt): 359 of 512 k-points Info(nonlinopt): 101 of 512 k-points Info(nonlinopt): 360 of 512 k-points Info(nonlinopt): 361 of 512 k-points Info(nonlinopt): 102 of 512 k-points Info(nonlinopt): 362 of 512 k-points Info(nonlinopt): 103 of 512 k-points Info(nonlinopt): 104 of 512 k-points Info(nonlinopt): 363 of 512 k-points Info(nonlinopt): 105 of 512 k-points Info(nonlinopt): 364 of 512 k-points Info(nonlinopt): 365 of 512 k-points Info(nonlinopt): 106 of 512 k-points Info(nonlinopt): 366 of 512 k-points Info(nonlinopt): 367 of 512 k-points Info(nonlinopt): 107 of 512 k-points 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Info(nonlinopt): 229 of 512 k-points Info(nonlinopt): 490 of 512 k-points Info(nonlinopt): 230 of 512 k-points Info(nonlinopt): 491 of 512 k-points Info(nonlinopt): 231 of 512 k-points Info(nonlinopt): 492 of 512 k-points Info(nonlinopt): 232 of 512 k-points Info(nonlinopt): 493 of 512 k-points Info(nonlinopt): 494 of 512 k-points Info(nonlinopt): 233 of 512 k-points Info(nonlinopt): 495 of 512 k-points Info(nonlinopt): 496 of 512 k-points Info(nonlinopt): 234 of 512 k-points Info(nonlinopt): 497 of 512 k-points Info(nonlinopt): 235 of 512 k-points Info(nonlinopt): 498 of 512 k-points Info(nonlinopt): 236 of 512 k-points Info(nonlinopt): 499 of 512 k-points Info(nonlinopt): 237 of 512 k-points Info(nonlinopt): 500 of 512 k-points Info(nonlinopt): 238 of 512 k-points Info(nonlinopt): 501 of 512 k-points Info(nonlinopt): 239 of 512 k-points Info(nonlinopt): 502 of 512 k-points Info(nonlinopt): 240 of 512 k-points Info(nonlinopt): 503 of 512 k-points Info(nonlinopt): 241 of 512 k-points Info(nonlinopt): 504 of 512 k-points Info(nonlinopt): 242 of 512 k-points Info(nonlinopt): 505 of 512 k-points Info(nonlinopt): 506 of 512 k-points Info(nonlinopt): 243 of 512 k-points Info(nonlinopt): 507 of 512 k-points Info(nonlinopt): 244 of 512 k-points Info(nonlinopt): 245 of 512 k-points Info(nonlinopt): 508 of 512 k-points Info(nonlinopt): 246 of 512 k-points Info(nonlinopt): 509 of 512 k-points Info(nonlinopt): 247 of 512 k-points Info(nonlinopt): 510 of 512 k-points Info(nonlinopt): 248 of 512 k-points Info(nonlinopt): 511 of 512 k-points Info(nonlinopt): 249 of 512 k-points Info(nonlinopt): 512 of 512 k-points Info(nonlinopt): 250 of 512 k-points Info(nonlinopt): 251 of 512 k-points Info(nonlinopt): 252 of 512 k-points Info(nonlinopt): 253 of 512 k-points Info(nonlinopt): 254 of 512 k-points Info(nonlinopt): 255 of 512 k-points Info(nonlinopt): 256 of 512 k-points Info(nonlinopt): susceptibility tensor written to CHI_abc.OUT interband contributions written to CHI_INTERx_abc.OUT intraband contributions written to CHI_INTRAx_abc.OUT for components a = 1, b = 1, c = 1 Info(elk): current task : 320 Info(tddftlr): 1 of 512 k-points Info(tddftlr): 257 of 512 k-points Info(tddftlr): 258 of 512 k-points Info(tddftlr): 2 of 512 k-points Info(tddftlr): 259 of 512 k-points Info(tddftlr): 3 of 512 k-points Info(tddftlr): 260 of 512 k-points Info(tddftlr): 4 of 512 k-points Info(tddftlr): 261 of 512 k-points Info(tddftlr): 5 of 512 k-points Info(tddftlr): 262 of 512 k-points Info(tddftlr): 6 of 512 k-points Info(tddftlr): 263 of 512 k-points Info(tddftlr): 7 of 512 k-points Info(tddftlr): 264 of 512 k-points Info(tddftlr): 8 of 512 k-points Info(tddftlr): 265 of 512 k-points Info(tddftlr): 266 of 512 k-points Info(tddftlr): 9 of 512 k-points Info(tddftlr): 267 of 512 k-points Info(tddftlr): 10 of 512 k-points Info(tddftlr): 268 of 512 k-points Info(tddftlr): 11 of 512 k-points Info(tddftlr): 269 of 512 k-points Info(tddftlr): 12 of 512 k-points 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of 512 k-points Info(tddftlr): 192 of 512 k-points Info(tddftlr): 436 of 512 k-points Info(tddftlr): 193 of 512 k-points Info(tddftlr): 437 of 512 k-points Info(tddftlr): 194 of 512 k-points Info(tddftlr): 438 of 512 k-points Info(tddftlr): 195 of 512 k-points Info(tddftlr): 439 of 512 k-points Info(tddftlr): 196 of 512 k-points Info(tddftlr): 440 of 512 k-points Info(tddftlr): 197 of 512 k-points Info(tddftlr): 441 of 512 k-points Info(tddftlr): 198 of 512 k-points Info(tddftlr): 442 of 512 k-points Info(tddftlr): 199 of 512 k-points Info(tddftlr): 200 of 512 k-points Info(tddftlr): 443 of 512 k-points Info(tddftlr): 201 of 512 k-points Info(tddftlr): 444 of 512 k-points Info(tddftlr): 202 of 512 k-points Info(tddftlr): 203 of 512 k-points Info(tddftlr): 445 of 512 k-points Info(tddftlr): 446 of 512 k-points Info(tddftlr): 204 of 512 k-points Info(tddftlr): 205 of 512 k-points Info(tddftlr): 447 of 512 k-points Info(tddftlr): 206 of 512 k-points Info(tddftlr): 448 of 512 k-points Info(tddftlr): 449 of 512 k-points Info(tddftlr): 207 of 512 k-points Info(tddftlr): 450 of 512 k-points Info(tddftlr): 208 of 512 k-points Info(tddftlr): 451 of 512 k-points Info(tddftlr): 209 of 512 k-points Info(tddftlr): 210 of 512 k-points Info(tddftlr): 452 of 512 k-points Info(tddftlr): 211 of 512 k-points Info(tddftlr): 453 of 512 k-points Info(tddftlr): 212 of 512 k-points Info(tddftlr): 454 of 512 k-points Info(tddftlr): 455 of 512 k-points Info(tddftlr): 213 of 512 k-points Info(tddftlr): 214 of 512 k-points Info(tddftlr): 456 of 512 k-points Info(tddftlr): 215 of 512 k-points Info(tddftlr): 457 of 512 k-points Info(tddftlr): 216 of 512 k-points Info(tddftlr): 458 of 512 k-points Info(tddftlr): 217 of 512 k-points Info(tddftlr): 459 of 512 k-points Info(tddftlr): 218 of 512 k-points Info(tddftlr): 460 of 512 k-points Info(tddftlr): 219 of 512 k-points Info(tddftlr): 461 of 512 k-points Info(tddftlr): 462 of 512 k-points Info(tddftlr): 220 of 512 k-points Info(tddftlr): 463 of 512 k-points Info(tddftlr): 221 of 512 k-points Info(tddftlr): 464 of 512 k-points Info(tddftlr): 222 of 512 k-points Info(tddftlr): 465 of 512 k-points Info(tddftlr): 223 of 512 k-points Info(tddftlr): 224 of 512 k-points Info(tddftlr): 466 of 512 k-points Info(tddftlr): 225 of 512 k-points Info(tddftlr): 467 of 512 k-points Info(tddftlr): 226 of 512 k-points Info(tddftlr): 227 of 512 k-points Info(tddftlr): 468 of 512 k-points Info(tddftlr): 228 of 512 k-points Info(tddftlr): 229 of 512 k-points Info(tddftlr): 469 of 512 k-points Info(tddftlr): 230 of 512 k-points Info(tddftlr): 470 of 512 k-points Info(tddftlr): 231 of 512 k-points Info(tddftlr): 471 of 512 k-points Info(tddftlr): 232 of 512 k-points Info(tddftlr): 472 of 512 k-points Info(tddftlr): 233 of 512 k-points Info(tddftlr): 473 of 512 k-points Info(tddftlr): 234 of 512 k-points Info(tddftlr): 474 of 512 k-points Info(tddftlr): 235 of 512 k-points Info(tddftlr): 475 of 512 k-points Info(tddftlr): 236 of 512 k-points Info(tddftlr): 476 of 512 k-points Info(tddftlr): 237 of 512 k-points Info(tddftlr): 238 of 512 k-points Info(tddftlr): 477 of 512 k-points Info(tddftlr): 239 of 512 k-points Info(tddftlr): 240 of 512 k-points Info(tddftlr): 478 of 512 k-points Info(tddftlr): 479 of 512 k-points Info(tddftlr): 241 of 512 k-points Info(tddftlr): 242 of 512 k-points Info(tddftlr): 480 of 512 k-points Info(tddftlr): 243 of 512 k-points Info(tddftlr): 244 of 512 k-points Info(tddftlr): 481 of 512 k-points Info(tddftlr): 245 of 512 k-points Info(tddftlr): 482 of 512 k-points Info(tddftlr): 246 of 512 k-points Info(tddftlr): 483 of 512 k-points Info(tddftlr): 247 of 512 k-points Info(tddftlr): 248 of 512 k-points Info(tddftlr): 484 of 512 k-points Info(tddftlr): 249 of 512 k-points Info(tddftlr): 250 of 512 k-points Info(tddftlr): 485 of 512 k-points Info(tddftlr): 251 of 512 k-points Info(tddftlr): 486 of 512 k-points Info(tddftlr): 252 of 512 k-points Info(tddftlr): 487 of 512 k-points Info(tddftlr): 253 of 512 k-points Info(tddftlr): 488 of 512 k-points Info(tddftlr): 254 of 512 k-points Info(tddftlr): 489 of 512 k-points Info(tddftlr): 255 of 512 k-points Info(tddftlr): 256 of 512 k-points Info(tddftlr): 490 of 512 k-points Info(tddftlr): 491 of 512 k-points Info(tddftlr): 492 of 512 k-points Info(tddftlr): 493 of 512 k-points Info(tddftlr): 494 of 512 k-points Info(tddftlr): 495 of 512 k-points Info(tddftlr): 496 of 512 k-points Info(tddftlr): 497 of 512 k-points Info(tddftlr): 498 of 512 k-points Info(tddftlr): 499 of 512 k-points Info(tddftlr): 500 of 512 k-points Info(tddftlr): 501 of 512 k-points Info(tddftlr): 502 of 512 k-points Info(tddftlr): 503 of 512 k-points Info(tddftlr): 504 of 512 k-points Info(tddftlr): 505 of 512 k-points Info(tddftlr): 506 of 512 k-points Info(tddftlr): 507 of 512 k-points Info(tddftlr): 508 of 512 k-points Info(tddftlr): 509 of 512 k-points Info(tddftlr): 510 of 512 k-points Info(tddftlr): 511 of 512 k-points Info(tddftlr): 512 of 512 k-points Info(tddftlr): done 10 bootstrap iterations head of matrix v.f_xc : 0.3605216356 -0.2401473822E-14 Info(tddftlr): done 20 bootstrap iterations head of matrix v.f_xc : 0.1184337903 -0.6973276410E-14 Info(tddftlr): done 30 bootstrap iterations head of matrix v.f_xc : -0.5963769037 -0.3237030885E-13 Info(tddftlr): done 40 bootstrap iterations head of matrix v.f_xc : -38.56550181 -0.2677684419E-10 Info(tddftlr): done 50 bootstrap iterations head of matrix v.f_xc : 2.451071807 -0.4677048305E-13 Info(tddftlr): done 60 bootstrap iterations head of matrix v.f_xc : 1.648348155 -0.1177325679E-13 Info(tddftlr): done 70 bootstrap iterations head of matrix v.f_xc : 1.389495926 -0.5214154786E-14 Info(tddftlr): done 80 bootstrap iterations head of matrix v.f_xc : 1.262632324 -0.2826910543E-14 Info(tddftlr): done 90 bootstrap iterations head of matrix v.f_xc : 1.187934604 -0.1667657760E-14 Info(tddftlr): done 100 bootstrap iterations head of matrix v.f_xc : 1.139135744 -0.1003067111E-14 Info(tddftlr): done 110 bootstrap iterations head of matrix v.f_xc : 1.105058893 -0.5783630690E-15 Info(tddftlr): done 120 bootstrap iterations head of matrix v.f_xc : 1.080140586 -0.2850377375E-15 Info(tddftlr): done 130 bootstrap iterations head of matrix v.f_xc : 1.061298976 -0.7059100121E-16 Info(tddftlr): done 140 bootstrap iterations head of matrix v.f_xc : 1.046688417 0.9320424507E-16 Info(tddftlr): done 150 bootstrap iterations head of matrix v.f_xc : 1.035135755 0.2226220378E-15 Info(tddftlr): done 160 bootstrap iterations head of matrix v.f_xc : 1.025859386 0.3277373008E-15 Info(tddftlr): done 170 bootstrap iterations head of matrix v.f_xc : 1.018318363 0.4149040635E-15 Info(tddftlr): done 180 bootstrap iterations head of matrix v.f_xc : 1.012126352 0.4884820938E-15 Info(tddftlr): done 190 bootstrap iterations head of matrix v.f_xc : 1.007000087 0.5514173118E-15 Info(tddftlr): done 200 bootstrap iterations head of matrix v.f_xc : 1.002727191 0.6059245494E-15 Info(tddftlr): done 210 bootstrap iterations head of matrix v.f_xc : 0.9991453817 0.6534078095E-15 Info(tddftlr): done 220 bootstrap iterations head of matrix v.f_xc : 0.9961286063 0.6951068194E-15 Info(tddftlr): done 230 bootstrap iterations head of matrix v.f_xc : 0.9935775610 0.7319298641E-15 Info(tddftlr): done 240 bootstrap iterations head of matrix v.f_xc : 0.9914130502 0.7646261097E-15 Info(tddftlr): done 250 bootstrap iterations head of matrix v.f_xc : 0.9895712382 0.7936508879E-15 Info(tddftlr): done 260 bootstrap iterations head of matrix v.f_xc : 0.9880001917 0.8196085032E-15 Info(tddftlr): done 270 bootstrap iterations head of matrix v.f_xc : 0.9866573176 0.8427107579E-15 Info(tddftlr): done 280 bootstrap iterations head of matrix v.f_xc : 0.9855074368 0.8633895926E-15 Info(tddftlr): done 290 bootstrap iterations head of matrix v.f_xc : 0.9845213145 0.8819099057E-15 Info(tddftlr): done 300 bootstrap iterations head of matrix v.f_xc : 0.9836745260 0.8985400101E-15 Info(tddftlr): done 310 bootstrap iterations head of matrix v.f_xc : 0.9829465695 0.9134082877E-15 Info(tddftlr): done 320 bootstrap iterations head of matrix v.f_xc : 0.9823201667 0.9267386932E-15 Info(tddftlr): done 330 bootstrap iterations head of matrix v.f_xc : 0.9817807036 0.9386829872E-15 Info(tddftlr): done 340 bootstrap iterations head of matrix v.f_xc : 0.9813157824 0.9493916335E-15 Info(tddftlr): done 350 bootstrap iterations head of matrix v.f_xc : 0.9809148567 0.9590480365E-15 Info(tddftlr): done 360 bootstrap iterations head of matrix v.f_xc : 0.9805689344 0.9676409408E-15 Info(tddftlr): done 370 bootstrap iterations head of matrix v.f_xc : 0.9802703330 0.9753114710E-15 Info(tddftlr): done 380 bootstrap iterations head of matrix v.f_xc : 0.9800124775 0.9821793871E-15 Info(tddftlr): done 390 bootstrap iterations head of matrix v.f_xc : 0.9797897319 0.9883010125E-15 Info(tddftlr): done 400 bootstrap iterations head of matrix v.f_xc : 0.9795972590 0.9937825389E-15 Info(tddftlr): done 410 bootstrap iterations head of matrix v.f_xc : 0.9794309022 0.9986621539E-15 Info(tddftlr): done 420 bootstrap iterations head of matrix v.f_xc : 0.9792870863 0.1002992971E-14 Info(tddftlr): done 430 bootstrap iterations head of matrix v.f_xc : 0.9791627335 0.1006929488E-14 Info(tddftlr): done 440 bootstrap iterations head of matrix v.f_xc : 0.9790551919 0.1010453425E-14 Info(tddftlr): done 450 bootstrap iterations head of matrix v.f_xc : 0.9789621758 0.1013541988E-14 Info(tddftlr): done 460 bootstrap iterations head of matrix v.f_xc : 0.9788817133 0.1016246388E-14 Info(tddftlr): done 470 bootstrap iterations head of matrix v.f_xc : 0.9788121027 0.1018753433E-14 Info(tddftlr): done 480 bootstrap iterations head of matrix v.f_xc : 0.9787518750 0.1020940699E-14 Info(tddftlr): done 490 bootstrap iterations head of matrix v.f_xc : 0.9786997612 0.1022866869E-14 Info(tddftlr): done 500 bootstrap iterations head of matrix v.f_xc : 0.9786546651 0.1024664365E-14 Error(tddftlr): bootstrap kernel failed to converge Running test in directory test_024... Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 1.6441 Info(checkmt): reduced muffin-tin radius of species 2 (O) from 1.8000 to 1.3452 Info(findsymcrys): atomic basis shift (lattice) : -0.4650000000 0.000000000 0.000000000 See GEOMETRY.OUT for new atomic positions Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 1846 The leading minor of the overlap matrix of order 903 is not positive definite Order of overlap matrix : 943 Running test in directory test_025... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffb2f56873 in ??? #1 0x7fffb2f57f43 in ??? #2 0x7fffb2f599eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Co) from 2.4000 to 2.3401 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 17.71768676 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 18.21525421 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -36.81260133 -4.383400000 for s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 24.93752611 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 17.64976290 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -95.70742119 -4.383400000 for s.c. loop 5 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 32.82208824 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 17.84103576 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 17.67328230 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -55.94991629 -4.383400000 for s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.41820526 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.896176323 -4.383400000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 21.21433303 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 17.23169193 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 17.05831460 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 16.75287271 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 16.82591304 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 16.77941404 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 18.32001959 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 18.07003556 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 17.71542362 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 17.65495038 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 17.56605944 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 17.79759015 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 18.56451820 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 18.42877636 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 18.46664687 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 18.46759308 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 18.55330066 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 18.44742614 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 18.48685705 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 18.50496695 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 18.45238383 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 18.46091218 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 18.43271215 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 18.46247487 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 18.49729464 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 18.52308663 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 18.48494814 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 18.49467533 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 18.50240048 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 18.50134466 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 18.47949477 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 18.48432113 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 18.50618104 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 18.56562687 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 18.47604863 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 18.53518282 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 18.49850715 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 18.53691686 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 18.47826408 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 18.49044761 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 18.46016701 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 18.46554566 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 18.44613170 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 18.46936565 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 18.53178730 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 18.51787163 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 18.55794873 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 18.54724432 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 18.47680249 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 18.50381639 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 18.53656467 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 18.49403074 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 18.53588719 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 18.52589315 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 18.54111957 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 18.56409261 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 18.50820942 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 18.47962091 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 18.48724894 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 18.48172564 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 18.50443852 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 18.52987458 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 18.54708950 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 18.51468246 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 18.46374535 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 18.43080054 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 18.43012124 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 18.44975928 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 18.46698902 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 18.40209517 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 18.48760395 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 18.47022949 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 18.44754094 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 18.45817102 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 18.49934576 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 18.47021512 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 18.47806053 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 18.53289586 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 18.48683469 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 18.48410357 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 18.45114541 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 18.47432604 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 18.48872839 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 18.47958651 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 18.51785662 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 18.55861832 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 18.48282750 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 18.50244334 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 18.47305405 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 18.48546254 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 18.49500325 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 18.43436973 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 18.51301824 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 18.47363534 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 18.41026531 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 18.44936496 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 18.48603450 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 18.50004888 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 18.52437152 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 18.51169438 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 18.50169696 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 18.49421888 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 18.45130674 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 18.50925539 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 18.50414096 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 18.48808968 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 18.49688692 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 18.51690505 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 18.46299960 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 18.52799316 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 18.50434284 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 18.45827170 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 18.51402747 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 18.47018566 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 18.51477568 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 18.53132766 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 18.49273981 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 18.53200026 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 18.48154098 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 18.54849826 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 18.50710222 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 18.51004749 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 18.51630974 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 18.52218470 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 18.46486681 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 18.49312669 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 18.53579757 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 18.52474549 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 18.48831575 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 18.48332970 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 18.52365427 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 18.52054573 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 18.45477867 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 18.49401410 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 18.48194277 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 18.48869913 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 18.52927092 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 18.50321263 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 18.49131071 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 18.48826622 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 18.51175512 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 18.52046748 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 18.51031680 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 18.53248062 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 18.50538308 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 18.45916341 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 18.47752792 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 18.52072731 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 18.51736461 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 18.48852604 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 18.55838031 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 18.59010641 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 18.56396761 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 18.50474076 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 18.47823974 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 18.51820720 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 18.49040174 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 18.49320390 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 18.50777217 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 18.47404274 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 18.46594434 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 18.53167005 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 18.53859971 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 18.57899327 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 18.56962621 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 18.55148749 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 18.56275547 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 18.50435001 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 18.50817078 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 18.53333935 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 18.48257852 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 18.52841911 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 18.46392180 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 18.48658788 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 18.52409066 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 18.47098563 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 18.53111671 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 18.52217998 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 18.51510656 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 18.51538233 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 18.54067515 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 18.54148911 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 18.53746413 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 18.53924669 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 18.48093174 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 18.50574645 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 18.45316340 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 18.49766977 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 18.49835027 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 18.49877952 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 18.46372428 Required : 27.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 2 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 18.50600882 Required : 27.00000000 Info(elk): current task : 110 Warning(linengy): could not find 2 linearisation energies in s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 18.50351359 Required : 27.00000000 Info(mossbauer): Mossbauer parameters written to MOSSBAUER.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1391.14531329 TEST_000.OUT : -1357.35479362 absolute difference : 33.7905196700 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.139114531329E-01 Running test in directory test_026... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffa8af6873 in ??? #1 0x7fffa8af7f43 in ??? #2 0x7fffa8af99eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.3240 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.143167700 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 64.00952200 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 20.37818484 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 20.51199858 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 20.61186443 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 20.53418685 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 20.37875420 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 19.58968382 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 19.29444129 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.149252927 -4.590500000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 19.00661956 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 19.16197030 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.787294817 -4.590500000 for s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 19.14181116 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.648460462 -4.590500000 for s.c. loop 12 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 19.25362600 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.790644533 -4.590500000 for s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 19.21996633 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.817500995 -4.590500000 for s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 19.15992192 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.518733653 -4.590500000 for s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 19.29620825 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 19.20296349 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 19.25702713 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 19.30260709 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 19.32311042 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.741812444 -4.590500000 for s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 19.44973478 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -9.166112946 -4.590500000 for s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 19.53382700 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.261314630 -4.590500000 for s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 19.33868219 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 19.20370580 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 19.28420212 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.075067135 -4.590500000 for s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 19.20933914 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 18.91857065 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 19.27745341 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 19.30759498 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 19.34175574 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 19.28918936 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 19.41810347 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 19.31720109 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 19.32875448 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 19.32330824 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 19.24458196 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 19.30261587 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 19.23165185 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 19.32435849 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 19.21743710 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 19.30280178 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 19.29699053 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 19.28769073 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 19.30714117 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 19.32136414 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 19.27114632 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 19.34373087 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 19.18904502 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 19.32756706 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 19.27724669 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 19.35612423 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 19.30556682 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 19.40723318 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 19.55664956 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 19.66697116 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 19.14141520 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 19.32737328 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 19.30866060 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 19.70147765 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 19.32458193 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 19.18486122 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 19.22715567 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 19.21384281 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 19.35427129 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 19.40972686 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 19.43049041 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 19.44810031 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 19.27651898 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 19.54439448 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 19.08169233 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.634481228 -4.590500000 for s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 19.30989245 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 19.52077025 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 19.37483946 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 19.57755565 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 19.36828125 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 19.09825276 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.471026839 -4.590500000 for s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 19.67009351 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.276637265 -4.590500000 for s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 18.70464232 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.025729354 -4.590500000 for s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 18.73722930 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 19.25824284 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 19.12984035 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 19.12629900 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 19.30057462 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 19.32657097 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 19.14192976 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.361850193 -4.590500000 for s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 19.53202247 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 19.01834846 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 19.15572232 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 19.37862749 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 19.31764896 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 19.23688180 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 19.34699396 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 19.12710667 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 19.32696412 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 19.33235269 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 19.36492582 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 19.43828121 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.068135570 -4.590500000 for s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 19.31320709 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 19.08375028 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 19.20683569 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 19.72154426 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 19.14739647 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 19.26807132 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 19.42203252 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 19.29790399 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 19.35032539 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 19.33536116 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 19.34971756 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 19.34899462 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 19.23208575 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 19.28542971 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 19.26322030 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 19.43977569 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 19.35230903 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 19.28960378 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 19.34522634 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.046955316 -4.590500000 for s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 19.66761468 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 18.91110210 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 19.20390977 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 19.23915718 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 19.47581528 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 19.28156656 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 19.35898389 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 19.36049410 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 19.31455265 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 19.37805424 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 19.33303553 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 19.33955352 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 19.34136147 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.044668109 -4.590500000 for s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 19.57358064 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 19.27977567 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 19.09335313 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.412267871 -4.590500000 for s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 18.84564702 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.356602042 -4.590500000 for s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 19.44066057 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.196880135 -4.590500000 for s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 19.35734313 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.404843016 -4.590500000 for s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 19.33031302 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 19.46217275 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 19.31101232 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 19.23858033 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 19.24754245 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 19.27533528 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 19.32434596 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 19.39815387 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 19.26826593 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 19.38787976 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 19.30438129 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 19.28827110 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 19.27552753 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 19.37525616 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 18.42081929 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 18.49827565 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 18.93561990 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 19.13447953 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 19.16649679 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 19.17945178 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.347653565 -4.590500000 for s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 18.87700481 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 19.18117356 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 19.34356503 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 19.32136976 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 19.30234247 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 19.33369369 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 19.21185216 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 19.30357672 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 19.30668087 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.409193806 -4.590500000 for s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 19.10225804 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 19.28277761 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 19.40397100 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 19.20934683 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 19.11437178 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.540904645 -4.590500000 for s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 19.21029064 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 19.27038730 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 19.34974316 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 19.17489507 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 19.11233214 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 19.20092181 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.938243492 -4.590500000 for s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 19.30309149 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 19.13678104 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 19.07046462 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 19.24627310 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 19.21538555 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 19.17990569 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 19.17107638 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 19.22132522 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 19.20614275 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 19.21272610 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 19.05650666 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.969786943 -4.590500000 for s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 19.36440006 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.232782588 -4.590500000 for s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 19.55868652 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 19.22799816 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 19.29219409 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 19.27871235 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 19.30798590 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 19.38411231 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.673122438 -4.590500000 for s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 19.45350913 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 19.26231853 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 19.28558713 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 19.35447371 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 19.22554461 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 19.47684713 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.038726428 -4.590500000 for s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 19.65119847 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 19.21397591 Required : 28.00000000 Info(elk): current task : 170 Info(writeemd): 1 of 29 k-points Info(writeemd): 16 of 29 k-points Info(writeemd): 2 of 29 k-points Info(writeemd): 3 of 29 k-points Info(writeemd): 17 of 29 k-points Info(writeemd): 18 of 29 k-points Info(writeemd): 4 of 29 k-points Info(writeemd): 5 of 29 k-points Info(writeemd): 19 of 29 k-points Info(writeemd): 6 of 29 k-points Info(writeemd): 7 of 29 k-points Info(writeemd): 20 of 29 k-points Info(writeemd): 8 of 29 k-points Info(writeemd): 9 of 29 k-points Info(writeemd): 21 of 29 k-points Info(writeemd): 22 of 29 k-points Info(writeemd): 10 of 29 k-points Info(writeemd): 11 of 29 k-points Info(writeemd): 23 of 29 k-points Info(writeemd): 24 of 29 k-points Info(writeemd): 12 of 29 k-points Info(writeemd): 13 of 29 k-points Info(writeemd): 25 of 29 k-points Info(writeemd): 14 of 29 k-points Info(writeemd): 15 of 29 k-points Info(writeemd): 26 of 29 k-points Info(writeemd): 27 of 29 k-points Info(writeemd): 28 of 29 k-points Info(writeemd): 29 of 29 k-points Info(writeemd): electron momentum density written to EMD.OUT for all H+k-vectors up to |H+k| < hkmax Info(elk): current task : 171 Info(emdplot1d): done 1 of 10 points Info(emdplot1d): done 2 of 10 points Info(emdplot1d): done 3 of 10 points Info(emdplot1d): done 4 of 10 points Info(emdplot1d): done 5 of 10 points Info(emdplot1d): done 6 of 10 points Info(emdplot1d): done 7 of 10 points Info(emdplot1d): done 8 of 10 points Info(emdplot1d): done 9 of 10 points Info(emdplot1d): done 10 of 10 points Info(emdplot): 1D electron momentum density written to EMD1D.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1518.39244482 TEST_000.OUT : -1527.49557164 absolute difference : 9.10312682000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.151839244482E-01 Running test in directory test_027... Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 208 Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.4000 to 2.2879 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.4000 to 2.2879 Info(bornechg): working on BEC_S01_A001_P1.OUT Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.2879 to 2.2864 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.2879 to 2.2864 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 369 The leading minor of the overlap matrix of order 171 is not positive definite Order of overlap matrix : 198 Running test in directory test_028... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(findsymcrys): atomic basis shift (lattice) : -0.7316652200 -0.7316652200 0.000000000 See GEOMETRY.OUT for new atomic positions Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 668 The leading minor of the overlap matrix of order 239 is not positive definite Order of overlap matrix : 429 Running test in directory test_029... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff7c5f6873 in ??? #1 0x7fff7c5f7f43 in ??? #2 0x7fff7c5f99eb in ??? #3 0x100d3627 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x100186e3 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011b53 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Cr) from 2.4000 to 2.3521 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 32.21317517 Required : 48.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 32.31302615 Required : 48.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 32.52950222 Required : 48.00000000 Warning(gndstate): failed to reach self-consistency after 4 loops Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 32.41240456 Required : 48.00000000 Info(elk): current task : 700 Warning(occupyulr): minimum eigenvalue less than minimum linearisation energy : -107.5201051 -4.702000000 for s.c. loop 2 Warning(occupyulr): minimum eigenvalue less than minimum linearisation energy : -164.7487319 -4.702000000 for s.c. loop 3 Warning(gndstulr): failed to reach self-consistency after 4 loops Warning(occupyulr): minimum eigenvalue less than minimum linearisation energy : -258.9753631 -4.702000000 for s.c. loop 4 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -2090.80527682 TEST_000.OUT : -2013.79360491 absolute difference : 77.0116719100 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.209080527682E-01 Running test in directory test_030... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ti) from 2.4000 to 2.3082 Info(checkmt): reduced muffin-tin radius of species 2 (C) from 1.8000 to 1.7311 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 21.52255528 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 21.49350947 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 20.71163682 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 23.30948737 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 21.95461164 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 21.37121633 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 21.30208537 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 21.68872631 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 21.92964114 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 21.92191141 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 21.91442727 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 21.90853431 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 21.93406544 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 21.90670769 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 21.91203883 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 21.92835810 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 21.92973563 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 21.97168141 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 21.92200861 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 21.92139859 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 21.92186891 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 21.91981298 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 21.93405552 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 21.93533018 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 21.93238204 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 21.92500122 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 21.93290254 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 21.93898317 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 21.93157960 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 21.93051831 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 21.94036282 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 21.93588089 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 21.92763969 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 21.92532877 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 21.92572500 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 21.93475229 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 21.93352820 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 21.93268215 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 21.93364014 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 21.93198198 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 21.92432008 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 21.92983878 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 21.93638534 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 21.92426287 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 21.92975335 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 21.93299221 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 21.98390181 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 21.92805065 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 21.92703521 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 21.92895899 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 21.93450443 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 21.93178022 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 21.92713140 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 21.90331128 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 21.93033221 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 21.97516692 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 21.92629097 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 21.93401986 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 21.90486464 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 21.92578378 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 21.93677376 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 21.93057170 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 21.93830661 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 21.93540153 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 21.90239862 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 21.92759714 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 21.92274805 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 21.93643308 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 21.96132893 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 21.91998233 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 21.92738309 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 21.92341651 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 21.92658177 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 21.93457128 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 21.92693976 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 21.92829308 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 21.91963719 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 21.92680400 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 21.92142051 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 21.94370870 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 21.92636718 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 21.93371574 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 21.92801264 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 21.93277034 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 21.92252857 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 21.91752441 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 21.94116822 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 21.92997206 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 21.93759227 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 21.93092340 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 21.92356264 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 21.93099219 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 21.92526091 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 21.93714102 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 21.92726220 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 21.93000485 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 21.93326796 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 21.93067827 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 21.92702010 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 21.93142988 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 21.92507661 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 21.93563243 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 21.93806712 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 21.93929407 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 21.93137756 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 21.93128157 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 21.93288481 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 21.92305063 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 21.93674229 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 21.92281486 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 21.91889185 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 21.92237122 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 21.93051994 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 21.94247247 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 21.91248354 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 21.92357057 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 21.93119534 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 21.93152802 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 21.92316341 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 21.92951630 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 21.92848806 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 21.93172339 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 21.93242134 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 21.93074136 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 21.92277923 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 21.94699255 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 21.93087753 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 21.97980082 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 21.97400380 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 21.92760394 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 21.92496857 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 21.92765425 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 21.93173406 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 21.92155794 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 21.92516777 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 21.92355951 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 21.89064402 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 21.92901516 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 21.92058404 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 21.92205993 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 21.94108776 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 21.92395189 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 21.93278993 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 21.90524933 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 21.93258193 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 21.93298951 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 21.92783406 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 21.93114935 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 21.92864645 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 21.92962164 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 21.92542845 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 21.93429927 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 21.92975137 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 21.94429297 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 21.93524550 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 21.92292088 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 21.93110777 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 21.92439069 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 21.93380274 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 21.93344395 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 21.92095306 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 21.92701694 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 21.93425638 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 21.93261084 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 21.96940807 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 21.93676491 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 21.93577642 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 21.95845600 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 21.90459783 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 21.93539806 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 21.92963942 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 21.89918454 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 21.92062203 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 21.92929742 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 21.92619505 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 21.93735508 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 21.92643177 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 21.93388835 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 21.93283025 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 21.93442085 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 21.90784755 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 21.93276331 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 21.93220538 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 21.93158268 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 21.91434412 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 21.93033425 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 21.91905540 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 21.94425916 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 21.93015430 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 21.93306529 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 21.92824567 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 21.93676734 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 21.92909479 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 21.92605761 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 21.93235156 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 21.92405906 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 21.92831104 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 21.89787910 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 21.92823909 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 21.92920525 Required : 28.00000000 Info(elk): current task : 450 Info(genafieldt): Time-dependent A-field written to AFIELDT.OUT Laser pulse and ramp parameters written to TD_INFO.OUT 1 atomic unit of time is 24.18884327 attoseconds Total simulation time : 40.00000000 in attoseconds : 967.5537306 Info(elk): current task : 460 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 249 The leading minor of the overlap matrix of order 118 is not positive definite Order of overlap matrix : 131 real 87m59.391s user 125m11.607s sys 1m32.951s + rm -rf tests tests-libxc + . /etc/profile.d/modules.sh ++ . /etc/profile.d/00-modulepath.sh +++ '[' -z /etc/modulefiles:/usr/share/modulefiles:/usr/share/modulefiles/Linux:/usr/share/modulefiles/Core:/usr/share/lmod/lmod/modulefiles/Core ']' +++ : ++ '[' -z '' ']' ++ LMOD_ALLOW_ROOT_USE=yes ++ '[' -n '' ']' ++ '[' yes '!=' yes ']' ++ '[' -z /usr/share/modulefiles ']' ++ findExec READLINK_CMD /usr/bin/readlink readlink ++ Nm=READLINK_CMD ++ confPath=/usr/bin/readlink ++ execNm=readlink ++ eval READLINK_CMD=/usr/bin/readlink +++ READLINK_CMD=/usr/bin/readlink ++ '[' '!' -x /usr/bin/readlink ']' ++ unset Nm confPath execNm ++ findExec PS_CMD /usr/bin/ps ps ++ Nm=PS_CMD ++ confPath=/usr/bin/ps ++ execNm=ps ++ eval PS_CMD=/usr/bin/ps +++ PS_CMD=/usr/bin/ps ++ '[' '!' -x /usr/bin/ps ']' ++ unset Nm confPath execNm ++ findExec EXPR_CMD /usr/bin/expr expr ++ Nm=EXPR_CMD ++ confPath=/usr/bin/expr ++ execNm=expr ++ eval EXPR_CMD=/usr/bin/expr +++ EXPR_CMD=/usr/bin/expr ++ '[' '!' -x /usr/bin/expr ']' ++ unset Nm confPath execNm ++ findExec BASENAME_CMD /usr/bin/basename basename ++ Nm=BASENAME_CMD ++ confPath=/usr/bin/basename ++ execNm=basename ++ eval BASENAME_CMD=/usr/bin/basename +++ BASENAME_CMD=/usr/bin/basename ++ '[' '!' -x /usr/bin/basename ']' ++ unset Nm confPath execNm ++ unset -f findExec ++ '[' -f /proc/34955/exe ']' +++ /usr/bin/readlink /proc/34955/exe ++ my_shell=/usr/bin/bash +++ /usr/bin/expr /usr/bin/bash : '-*\(.*\)' ++ my_shell=/usr/bin/bash +++ /usr/bin/basename /usr/bin/bash ++ my_shell=bash ++ case ${my_shell} in ++ '[' -f /usr/share/lmod/lmod/init/bash ']' ++ . /usr/share/lmod/lmod/init/bash +++ '[' -z '' ']' +++ case "$-" in +++ __lmod_vx=x +++ '[' -n x ']' +++ set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for this output (/usr/share/lmod/lmod/init/bash) Shell debugging restarted +++ unset __lmod_vx ++ unset my_shell PS_CMD EXPR_CMD BASENAME_CMD MODULEPATH_INIT LMOD_ALLOW_ROOT_USE READLINK_CMD + module load mpi/openmpi-ppc64le + local __lmod_my_status + local __lmod_sh_dbg + '[' -z '' ']' + case "$-" in + __lmod_sh_dbg=x + '[' -n x ']' + set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for Lmod's output Shell debugging restarted + return 0 + export PRTE_MCA_rmaps_default_mapping_policy=:oversubscribe + PRTE_MCA_rmaps_default_mapping_policy=:oversubscribe + ELK_EXECUTABLE='mpiexec -np 1 ../../elk_openmpi' + cp -rp tests-libxc.orig tests-libxc + sed -i 's#../../src/elk#mpiexec -np 1 ../../elk_openmpi#g' tests-libxc/test.sh + sed -i '/Failed/ a cat test.log' tests-libxc/test.sh + tee test-libxc.1_openmpi.log + /usr/bin/make test-libxc cd tests-libxc; ./test.sh Running test in directory test_001... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.4000 to 2.2888 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.4000 to 2.2888 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 321 The leading minor of the overlap matrix of order 147 is not positive definite Order of overlap matrix : 174 Running test in directory test_002... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffaae16873 in ??? #1 0x7fffaae17f43 in ??? #2 0x7fffaae199eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.3297 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.888799720 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 26.31722817 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.675516866 -4.590500000 for s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 26.90471541 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 19.67674841 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.662160559 -4.590500000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 28.29721460 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 19.79879262 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 21.43893791 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 19.55204890 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 19.51718641 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 19.28677614 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 19.52651268 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 18.68483010 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 18.18188606 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 13 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.001820444 -4.590500000 for s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 20.06393353 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 19.49680244 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.044455382 -4.590500000 for s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 18.96810357 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 17.98173568 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.685720653 -4.590500000 for s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 17.44792972 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.699171689 -4.590500000 for s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 17.99508825 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 18.18112436 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.065657699 -4.590500000 for s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 18.23020197 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.282825735 -4.590500000 for s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 18.64969154 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 18.57894216 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.104128418 -4.590500000 for s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 18.01305050 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.443459266 -4.590500000 for s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 17.04126201 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 20.54408061 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 26 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -36.95965701 -4.590500000 for s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 531.9605005 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 27 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -31.42662299 -4.590500000 for s.c. loop 27 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 11 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 17 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 18 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 22 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 25 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 26 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 28 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 30 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 32 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 33 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 34 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 38 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 40 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 42 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 43 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 45 and s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 10.40540943 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 28 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.374197451 -4.590500000 for s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 17.62154139 Required : 28.00000000 Warning(linengy): could not find 9 linearisation energies in s.c. loop 29 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -100.3247367 -4.590500000 for s.c. loop 29 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 12 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 23 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 26 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 31 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 37 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 44 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 47 and s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 0.3162276987 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 30 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.020359947 -4.590500000 for s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 17.44051921 Required : 28.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 31 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.670412662 -4.590500000 for s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 22.26647215 Required : 28.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 22.69083205 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 21.98478611 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 21.72735476 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 20.77158668 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 20.67102125 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 20.59457601 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 20.52578027 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 20.69604134 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 20.20299384 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 20.33026623 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 20.61703223 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 20.65536186 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 20.57967311 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 20.68181654 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 20.15753597 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 20.04684029 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 20.04749650 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 19.52958284 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 19.98827474 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 19.79463359 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 19.81081488 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 19.29877269 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 19.55802250 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 19.32983039 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 19.43736566 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 19.23288486 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 20.14629734 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 19.22939986 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 20.40404763 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 19.66342037 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 20.05872245 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 19.73661603 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 19.60051488 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 19.74496008 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 19.94007472 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 20.07552360 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 19.98650327 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 20.46873744 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 20.25493098 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 20.42568444 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 20.27615379 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 20.03270604 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 18.88423822 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 19.76416900 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 19.69416569 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 19.82956266 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 19.87475395 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 20.27212954 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 20.23015518 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 20.36994187 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 20.31798030 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 20.26801733 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 20.08991729 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 20.35837899 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 20.14831564 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 20.14516028 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 20.43342907 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 20.38066619 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 20.26934014 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 20.45271257 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 20.53158027 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 20.65094259 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 20.49413294 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 19.88857857 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 20.34865101 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 20.32382387 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 20.17895816 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 20.24257442 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 20.50389411 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 19.82990884 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 20.45972156 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 20.59618655 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 20.60946454 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 20.66443896 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 20.45304070 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 20.27723446 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 20.24659644 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 20.22604237 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 20.18438026 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 19.95637721 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 20.18381539 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 20.06293020 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 20.01787472 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 20.19607460 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 20.32305619 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 20.26517163 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 20.45448718 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 20.58049852 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 20.55030666 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 19.87752118 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 20.20409316 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 20.11811774 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 20.22746496 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 20.17388042 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 20.23311466 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 20.22006665 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 20.26239629 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 20.34084948 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 20.60080603 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 20.30515084 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 20.31060591 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 20.11830946 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 20.43943225 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 20.28479998 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 20.22568958 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 20.35458277 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 20.51521295 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 20.46157491 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 20.57691856 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 20.43614614 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 20.30628450 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 20.53130231 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 20.47213889 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 20.72718489 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 20.25885520 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 20.61652280 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 19.65512545 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 19.64473905 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 19.95637100 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 20.07908346 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 20.41645571 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 20.23962826 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 20.50538156 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 20.30845628 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 20.48824047 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 20.10974415 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 20.54066280 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 20.58565091 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 20.66958102 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 20.56239285 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 19.85821057 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 20.62668051 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 20.20681793 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 20.30711651 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 20.16129999 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 20.51830182 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 20.72941626 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 20.61374838 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 20.46529090 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 20.54442691 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 20.54783979 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 20.59523176 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 20.56745295 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 20.64173574 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 20.60498888 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 20.37008808 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 20.52577589 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 20.48483464 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 19.75565543 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 20.56471915 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 19.89761449 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 20.57125510 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 19.86774217 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 20.49147584 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 20.46237748 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 20.14880776 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 20.11942230 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 20.48871934 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 20.13948540 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 20.60323261 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 20.38498591 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 20.03466809 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 20.34686935 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 20.46347464 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 20.44003606 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 20.25362134 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 20.50885040 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 20.41221860 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 20.51149418 Required : 28.00000000 Info(elk): current task : 330 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Info(tddftsplr): 126 of 1000 k-points Info(tddftsplr): 501 of 1000 k-points Info(tddftsplr): 376 of 1000 k-points Info(tddftsplr): 251 of 1000 k-points Info(tddftsplr): 1 of 1000 k-points Info(tddftsplr): 876 of 1000 k-points Info(tddftsplr): 751 of 1000 k-points Info(tddftsplr): 626 of 1000 k-points Info(tddftsplr): 2 of 1000 k-points Info(tddftsplr): 752 of 1000 k-points Info(tddftsplr): 877 of 1000 k-points Info(tddftsplr): 502 of 1000 k-points Info(tddftsplr): 627 of 1000 k-points Info(tddftsplr): 377 of 1000 k-points Info(tddftsplr): 252 of 1000 k-points Info(tddftsplr): 127 of 1000 k-points Info(tddftsplr): 3 of 1000 k-points Info(tddftsplr): 753 of 1000 k-points Info(tddftsplr): 253 of 1000 k-points Info(tddftsplr): 878 of 1000 k-points Info(tddftsplr): 628 of 1000 k-points Info(tddftsplr): 503 of 1000 k-points Info(tddftsplr): 378 of 1000 k-points Info(tddftsplr): 128 of 1000 k-points Info(tddftsplr): 4 of 1000 k-points Info(tddftsplr): 879 of 1000 k-points Info(tddftsplr): 254 of 1000 k-points Info(tddftsplr): 754 of 1000 k-points Info(tddftsplr): 629 of 1000 k-points Info(tddftsplr): 504 of 1000 k-points Info(tddftsplr): 379 of 1000 k-points Info(tddftsplr): 129 of 1000 k-points Info(tddftsplr): 5 of 1000 k-points Info(tddftsplr): 880 of 1000 k-points Info(tddftsplr): 755 of 1000 k-points Info(tddftsplr): 630 of 1000 k-points Info(tddftsplr): 505 of 1000 k-points Info(tddftsplr): 255 of 1000 k-points Info(tddftsplr): 380 of 1000 k-points Info(tddftsplr): 130 of 1000 k-points Info(tddftsplr): 6 of 1000 k-points Info(tddftsplr): 881 of 1000 k-points Info(tddftsplr): 756 of 1000 k-points Info(tddftsplr): 506 of 1000 k-points Info(tddftsplr): 631 of 1000 k-points Info(tddftsplr): 256 of 1000 k-points Info(tddftsplr): 131 of 1000 k-points Info(tddftsplr): 381 of 1000 k-points Info(tddftsplr): 7 of 1000 k-points Info(tddftsplr): 882 of 1000 k-points Info(tddftsplr): 507 of 1000 k-points Info(tddftsplr): 757 of 1000 k-points Info(tddftsplr): 632 of 1000 k-points Info(tddftsplr): 257 of 1000 k-points Info(tddftsplr): 132 of 1000 k-points Info(tddftsplr): 382 of 1000 k-points Info(tddftsplr): 8 of 1000 k-points Info(tddftsplr): 508 of 1000 k-points Info(tddftsplr): 883 of 1000 k-points Info(tddftsplr): 633 of 1000 k-points Info(tddftsplr): 758 of 1000 k-points Info(tddftsplr): 258 of 1000 k-points Info(tddftsplr): 133 of 1000 k-points Info(tddftsplr): 383 of 1000 k-points Info(tddftsplr): 9 of 1000 k-points Info(tddftsplr): 509 of 1000 k-points Info(tddftsplr): 884 of 1000 k-points Info(tddftsplr): 634 of 1000 k-points Info(tddftsplr): 259 of 1000 k-points Info(tddftsplr): 134 of 1000 k-points Info(tddftsplr): 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Info(tddftsplr): 870 of 1000 k-points Info(tddftsplr): 496 of 1000 k-points Info(tddftsplr): 621 of 1000 k-points Info(tddftsplr): 122 of 1000 k-points Info(tddftsplr): 998 of 1000 k-points Info(tddftsplr): 245 of 1000 k-points Info(tddftsplr): 746 of 1000 k-points Info(tddftsplr): 371 of 1000 k-points Info(tddftsplr): 871 of 1000 k-points Info(tddftsplr): 497 of 1000 k-points Info(tddftsplr): 622 of 1000 k-points Info(tddftsplr): 123 of 1000 k-points Info(tddftsplr): 999 of 1000 k-points Info(tddftsplr): 747 of 1000 k-points Info(tddftsplr): 246 of 1000 k-points Info(tddftsplr): 372 of 1000 k-points Info(tddftsplr): 872 of 1000 k-points Info(tddftsplr): 498 of 1000 k-points Info(tddftsplr): 623 of 1000 k-points Info(tddftsplr): 124 of 1000 k-points Info(tddftsplr): 1000 of 1000 k-points Info(tddftsplr): 748 of 1000 k-points Info(tddftsplr): 247 of 1000 k-points Info(tddftsplr): 373 of 1000 k-points Info(tddftsplr): 873 of 1000 k-points Info(tddftsplr): 125 of 1000 k-points Info(tddftsplr): 624 of 1000 k-points Info(tddftsplr): 499 of 1000 k-points Info(tddftsplr): 749 of 1000 k-points Info(tddftsplr): 248 of 1000 k-points Info(tddftsplr): 374 of 1000 k-points Info(tddftsplr): 874 of 1000 k-points Info(tddftsplr): 625 of 1000 k-points Info(tddftsplr): 500 of 1000 k-points Info(tddftsplr): 750 of 1000 k-points Info(tddftsplr): 249 of 1000 k-points Info(tddftsplr): 375 of 1000 k-points Info(tddftsplr): 875 of 1000 k-points Info(tddftsplr): 250 of 1000 k-points Info(tddftsplr): Spin-dependent response function chi_ij(G,G',q,w) written to CHI_ij.OUT for i,j = 0-3; G = G' = 0; and all wplot frequencies q-vector (lattice coordinates) : 0.1000000000 0.3000000000 0.000000000 q-vector length : 0.4621801190 The elements of chi labeled by (i,j) form the 4x4 matrix : (_|_ _ _) chi(G,G',q,w) = ( | ) ( | ) ( | ) (0,0) is the charge-charge response drho/dv (0,1-3) is the charge-magnetisation response drho/dB (1-3,0) is the magnetisation-charge response dm/v (1-3,1-3) is the magnetisation-magnetisation response dm/dB Non-interacting Kohn-Sham reponse function written to CHI0_ij.OUT Transverse components corresponding to m_+- = m_x +- im_y written to CHI_T.OUT and CHI0_T.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1517.12685504 TEST_000.OUT : -1466.09290106 absolute difference : 51.0339539800 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.151712685504E-01 Running test in directory test_003... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.2310 Info(checkmt): reduced muffin-tin radius of species 2 (Co) from 2.4000 to 2.2310 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 208 The leading minor of the overlap matrix of order 89 is not positive definite Order of overlap matrix : 119 Running test in directory test_004... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffae4a6873 in ??? #1 0x7fffae4a7f43 in ??? #2 0x7fffae4a99eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.24661092 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.24999501 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.41698933 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.51176029 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.54006153 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.54593224 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.54703537 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.54712565 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.54741584 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.54752245 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 25.54757106 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 25.54754839 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 25.54753970 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 25.54753980 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 25.54753997 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 25.54753999 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 25.54753999 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 25.54754001 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 25.54754000 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 25.54754000 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 25.54754000 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 25.54754000 Required : 28.00000000 Info(elk): current task : 120 Info(genpmat): 5 of 29 k-points Info(genpmat): 1 of 29 k-points Info(genpmat): 27 of 29 k-points Info(genpmat): 24 of 29 k-points Info(genpmat): 21 of 29 k-points Info(genpmat): 17 of 29 k-points Info(genpmat): 13 of 29 k-points Info(genpmat): 9 of 29 k-points Info(genpmat): 25 of 29 k-points Info(genpmat): 2 of 29 k-points Info(genpmat): 6 of 29 k-points Info(genpmat): 18 of 29 k-points Info(genpmat): 14 of 29 k-points Info(genpmat): 22 of 29 k-points Info(genpmat): 28 of 29 k-points Info(genpmat): 10 of 29 k-points Info(genpmat): 29 of 29 k-points Info(genpmat): 3 of 29 k-points Info(genpmat): 19 of 29 k-points Info(genpmat): 7 of 29 k-points Info(genpmat): 15 of 29 k-points Info(genpmat): 26 of 29 k-points Info(genpmat): 23 of 29 k-points Info(genpmat): 11 of 29 k-points Info(genpmat): 8 of 29 k-points Info(genpmat): 4 of 29 k-points Info(genpmat): 12 of 29 k-points Info(genpmat): 16 of 29 k-points Info(genpmat): 20 of 29 k-points Info(writepmat): momentum matrix elements written to file PMAT.OUT Info(elk): current task : 121 Info(dielectric): dielectric tensor written to EPSILON_ij.OUT optical conductivity written to SIGMA_ij.OUT for components i = 1, j = 1 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -538.189221047 TEST_000.OUT : -538.561900086 absolute difference : 0.372679039000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.538189221047E-02 Running test in directory test_005... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffa91a6873 in ??? #1 0x7fffa91a7f43 in ??? #2 0x7fffa91a99eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 3 (Cu) from 2.4000 to 1.9694 Info(checkmt): reduced muffin-tin radius of species 4 (O) from 1.8000 to 1.4770 Info(findsymcrys): atomic basis shift (lattice) : -0.5000000000 -0.5000000000 -0.5000000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 330.2427476 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 343.3900266 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 336.6398879 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 375.5905878 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 360.3313653 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 343.5965897 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 984.0569130 Required : 294.0000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 18898.96132 Required : 294.0000000 Warning(linengy): could not find 13 linearisation energies in s.c. loop 9 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -38.54514187 -5.251500000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 128.0105027 Required : 294.0000000 Warning(gndstate): failed to reach self-consistency after 10 loops Warning(linengy): could not find 13 linearisation energies in s.c. loop 10 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -20.70463096 -5.251500000 for s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 128.0146964 Required : 294.0000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -25129.0485518 TEST_000.OUT : -32237.8701203 absolute difference : 7108.82156850 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.251290485518 Running test in directory test_006... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffb1766873 in ??? #1 0x7fffb1767f43 in ??? #2 0x7fffb17699eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.80006961 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.79778549 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.73540958 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.67918507 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.63646830 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.61683291 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.60946757 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.60947800 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.60950470 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.60950671 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 25.60950524 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 25.60950412 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 25.60950320 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 25.60950327 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 25.60950333 Required : 28.00000000 Info(elk): current task : 5 Info(genkmat): 1 of 16 k-points Info(genkmat): 3 of 16 k-points Info(genkmat): 15 of 16 k-points Info(genkmat): 13 of 16 k-points Info(genkmat): 11 of 16 k-points Info(genkmat): 9 of 16 k-points Info(genkmat): 7 of 16 k-points Info(genkmat): 5 of 16 k-points Info(genkmat): 14 of 16 k-points Info(genkmat): 6 of 16 k-points Info(genkmat): 4 of 16 k-points Info(genkmat): 10 of 16 k-points Info(genkmat): 16 of 16 k-points Info(genkmat): 2 of 16 k-points Info(genkmat): 8 of 16 k-points Info(genkmat): 12 of 16 k-points Info(hartfock): self-consistent loop number : 1 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.73601358 Required : 28.00000000 Info(hartfock): self-consistent loop number : 2 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.32842366 Required : 28.00000000 Info(hartfock): self-consistent loop number : 3 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -2.275053670 -2.000000000 for s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.31474201 Required : 28.00000000 Info(hartfock): self-consistent loop number : 4 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.46275776 Required : 28.00000000 Info(hartfock): self-consistent loop number : 5 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.40329283 Required : 28.00000000 Info(hartfock): self-consistent loop number : 6 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.32860542 Required : 28.00000000 Info(hartfock): self-consistent loop number : 7 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.28821718 Required : 28.00000000 Info(hartfock): self-consistent loop number : 8 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.24536097 Required : 28.00000000 Info(hartfock): self-consistent loop number : 9 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.24366259 Required : 28.00000000 Info(hartfock): self-consistent loop number : 10 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.17056981 Required : 28.00000000 Info(hartfock): self-consistent loop number : 11 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 25.29702525 Required : 28.00000000 Info(hartfock): self-consistent loop number : 12 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 25.39006142 Required : 28.00000000 Info(hartfock): self-consistent loop number : 13 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 25.27738227 Required : 28.00000000 Info(hartfock): self-consistent loop number : 14 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 25.32085461 Required : 28.00000000 Info(hartfock): self-consistent loop number : 15 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 25.19828598 Required : 28.00000000 Info(hartfock): self-consistent loop number : 16 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 25.22591850 Required : 28.00000000 Info(hartfock): self-consistent loop number : 17 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 25.25050531 Required : 28.00000000 Info(hartfock): self-consistent loop number : 18 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 25.29362473 Required : 28.00000000 Info(hartfock): self-consistent loop number : 19 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 25.22853281 Required : 28.00000000 Info(hartfock): self-consistent loop number : 20 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 25.30920070 Required : 28.00000000 Info(hartfock): self-consistent loop number : 21 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 25.15103278 Required : 28.00000000 Info(hartfock): self-consistent loop number : 22 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 25.19101628 Required : 28.00000000 Info(hartfock): self-consistent loop number : 23 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 25.33527345 Required : 28.00000000 Info(hartfock): self-consistent loop number : 24 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 25.30876382 Required : 28.00000000 Info(hartfock): self-consistent loop number : 25 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 25.23464414 Required : 28.00000000 Info(hartfock): self-consistent loop number : 26 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 25.20898951 Required : 28.00000000 Info(hartfock): self-consistent loop number : 27 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 25.33089237 Required : 28.00000000 Info(hartfock): self-consistent loop number : 28 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 25.25329325 Required : 28.00000000 Info(hartfock): self-consistent loop number : 29 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 25.11664061 Required : 28.00000000 Info(hartfock): self-consistent loop number : 30 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 25.29254842 Required : 28.00000000 Info(hartfock): self-consistent loop number : 31 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 25.22978590 Required : 28.00000000 Info(hartfock): self-consistent loop number : 32 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 25.12101324 Required : 28.00000000 Info(hartfock): self-consistent loop number : 33 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 25.20432496 Required : 28.00000000 Info(hartfock): self-consistent loop number : 34 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 25.25971194 Required : 28.00000000 Info(hartfock): self-consistent loop number : 35 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 25.44059142 Required : 28.00000000 Info(hartfock): self-consistent loop number : 36 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 25.21076749 Required : 28.00000000 Info(hartfock): self-consistent loop number : 37 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 25.27681041 Required : 28.00000000 Info(hartfock): self-consistent loop number : 38 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 25.14923841 Required : 28.00000000 Info(hartfock): self-consistent loop number : 39 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 25.35241150 Required : 28.00000000 Info(hartfock): self-consistent loop number : 40 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 25.32366630 Required : 28.00000000 Info(hartfock): self-consistent loop number : 41 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 25.24569757 Required : 28.00000000 Info(hartfock): self-consistent loop number : 42 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 25.29131289 Required : 28.00000000 Info(hartfock): self-consistent loop number : 43 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 25.12584712 Required : 28.00000000 Info(hartfock): self-consistent loop number : 44 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 25.22966122 Required : 28.00000000 Info(hartfock): self-consistent loop number : 45 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 25.20984763 Required : 28.00000000 Info(hartfock): self-consistent loop number : 46 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 25.33377302 Required : 28.00000000 Info(hartfock): self-consistent loop number : 47 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 25.33596426 Required : 28.00000000 Info(hartfock): self-consistent loop number : 48 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 25.29030375 Required : 28.00000000 Info(hartfock): self-consistent loop number : 49 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 25.22513787 Required : 28.00000000 Info(hartfock): self-consistent loop number : 50 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 25.54935407 Required : 28.00000000 Info(hartfock): self-consistent loop number : 51 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 25.32222977 Required : 28.00000000 Info(hartfock): self-consistent loop number : 52 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 25.27670715 Required : 28.00000000 Info(hartfock): self-consistent loop number : 53 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 25.26671887 Required : 28.00000000 Info(hartfock): self-consistent loop number : 54 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 25.20434609 Required : 28.00000000 Info(hartfock): self-consistent loop number : 55 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 25.22656745 Required : 28.00000000 Info(hartfock): self-consistent loop number : 56 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 25.34308940 Required : 28.00000000 Info(hartfock): self-consistent loop number : 57 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 25.26507601 Required : 28.00000000 Info(hartfock): self-consistent loop number : 58 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 25.40472221 Required : 28.00000000 Info(hartfock): self-consistent loop number : 59 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 25.40964163 Required : 28.00000000 Info(hartfock): self-consistent loop number : 60 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 25.36412118 Required : 28.00000000 Info(hartfock): self-consistent loop number : 61 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 25.37102785 Required : 28.00000000 Info(hartfock): self-consistent loop number : 62 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 25.28274843 Required : 28.00000000 Info(hartfock): self-consistent loop number : 63 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 25.35836504 Required : 28.00000000 Info(hartfock): self-consistent loop number : 64 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 25.25567843 Required : 28.00000000 Info(hartfock): self-consistent loop number : 65 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 25.26356486 Required : 28.00000000 Info(hartfock): self-consistent loop number : 66 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 25.38610081 Required : 28.00000000 Info(hartfock): self-consistent loop number : 67 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 25.36448261 Required : 28.00000000 Info(hartfock): self-consistent loop number : 68 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 25.30174840 Required : 28.00000000 Info(hartfock): self-consistent loop number : 69 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 25.41168385 Required : 28.00000000 Info(hartfock): self-consistent loop number : 70 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 25.26195207 Required : 28.00000000 Info(hartfock): self-consistent loop number : 71 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 25.25840182 Required : 28.00000000 Info(hartfock): self-consistent loop number : 72 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 25.27619720 Required : 28.00000000 Info(hartfock): self-consistent loop number : 73 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 25.46398219 Required : 28.00000000 Info(hartfock): self-consistent loop number : 74 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 25.10975031 Required : 28.00000000 Info(hartfock): self-consistent loop number : 75 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 25.17959553 Required : 28.00000000 Info(hartfock): self-consistent loop number : 76 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 25.17754998 Required : 28.00000000 Info(hartfock): self-consistent loop number : 77 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 25.25534115 Required : 28.00000000 Info(hartfock): self-consistent loop number : 78 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 25.27132431 Required : 28.00000000 Info(hartfock): self-consistent loop number : 79 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 25.32078985 Required : 28.00000000 Info(hartfock): self-consistent loop number : 80 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 25.26222365 Required : 28.00000000 Info(hartfock): self-consistent loop number : 81 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 25.31170095 Required : 28.00000000 Info(hartfock): self-consistent loop number : 82 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 25.16184817 Required : 28.00000000 Info(hartfock): self-consistent loop number : 83 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 25.26549209 Required : 28.00000000 Info(hartfock): self-consistent loop number : 84 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 25.19816854 Required : 28.00000000 Info(hartfock): self-consistent loop number : 85 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 25.34385312 Required : 28.00000000 Info(hartfock): self-consistent loop number : 86 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 25.32924936 Required : 28.00000000 Info(hartfock): self-consistent loop number : 87 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 25.24948527 Required : 28.00000000 Info(hartfock): self-consistent loop number : 88 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 25.17066276 Required : 28.00000000 Info(hartfock): self-consistent loop number : 89 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 25.28407652 Required : 28.00000000 Info(hartfock): self-consistent loop number : 90 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 25.41715037 Required : 28.00000000 Info(hartfock): self-consistent loop number : 91 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 25.36894222 Required : 28.00000000 Info(hartfock): self-consistent loop number : 92 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 25.43374380 Required : 28.00000000 Info(hartfock): self-consistent loop number : 93 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 25.32038278 Required : 28.00000000 Info(hartfock): self-consistent loop number : 94 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 25.36035879 Required : 28.00000000 Info(hartfock): self-consistent loop number : 95 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 25.15566868 Required : 28.00000000 Info(hartfock): self-consistent loop number : 96 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 25.21605630 Required : 28.00000000 Info(hartfock): self-consistent loop number : 97 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 25.25942472 Required : 28.00000000 Info(hartfock): self-consistent loop number : 98 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 25.11341500 Required : 28.00000000 Info(hartfock): self-consistent loop number : 99 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 25.22371630 Required : 28.00000000 Info(hartfock): self-consistent loop number : 100 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 25.26694059 Required : 28.00000000 Info(hartfock): self-consistent loop number : 101 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 25.24783443 Required : 28.00000000 Info(hartfock): self-consistent loop number : 102 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 25.25226022 Required : 28.00000000 Info(hartfock): self-consistent loop number : 103 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 25.32411892 Required : 28.00000000 Info(hartfock): self-consistent loop number : 104 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 25.21917454 Required : 28.00000000 Info(hartfock): self-consistent loop number : 105 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 25.31861677 Required : 28.00000000 Info(hartfock): self-consistent loop number : 106 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 25.11635427 Required : 28.00000000 Info(hartfock): self-consistent loop number : 107 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 25.23236755 Required : 28.00000000 Info(hartfock): self-consistent loop number : 108 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 25.25966126 Required : 28.00000000 Info(hartfock): self-consistent loop number : 109 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 25.27218061 Required : 28.00000000 Info(hartfock): self-consistent loop number : 110 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 25.24754332 Required : 28.00000000 Info(hartfock): self-consistent loop number : 111 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 25.25950221 Required : 28.00000000 Info(hartfock): self-consistent loop number : 112 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 25.27515473 Required : 28.00000000 Info(hartfock): self-consistent loop number : 113 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 25.37036877 Required : 28.00000000 Info(hartfock): self-consistent loop number : 114 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 25.21735934 Required : 28.00000000 Info(hartfock): self-consistent loop number : 115 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 25.29472137 Required : 28.00000000 Info(hartfock): self-consistent loop number : 116 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 25.22844071 Required : 28.00000000 Info(hartfock): self-consistent loop number : 117 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 25.23452497 Required : 28.00000000 Info(hartfock): self-consistent loop number : 118 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 25.19897939 Required : 28.00000000 Info(hartfock): self-consistent loop number : 119 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 25.40906852 Required : 28.00000000 Info(hartfock): self-consistent loop number : 120 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 25.28448118 Required : 28.00000000 Info(hartfock): self-consistent loop number : 121 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 25.18121810 Required : 28.00000000 Info(hartfock): self-consistent loop number : 122 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 25.28176733 Required : 28.00000000 Info(hartfock): self-consistent loop number : 123 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 25.12916305 Required : 28.00000000 Info(hartfock): self-consistent loop number : 124 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 25.42418780 Required : 28.00000000 Info(hartfock): self-consistent loop number : 125 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 25.27325929 Required : 28.00000000 Info(hartfock): self-consistent loop number : 126 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 25.27780824 Required : 28.00000000 Info(hartfock): self-consistent loop number : 127 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 25.16993499 Required : 28.00000000 Info(hartfock): self-consistent loop number : 128 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 25.30379789 Required : 28.00000000 Info(hartfock): self-consistent loop number : 129 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 25.36606201 Required : 28.00000000 Info(hartfock): self-consistent loop number : 130 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 25.25601358 Required : 28.00000000 Info(hartfock): self-consistent loop number : 131 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 25.46004526 Required : 28.00000000 Info(hartfock): self-consistent loop number : 132 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 25.20269958 Required : 28.00000000 Info(hartfock): self-consistent loop number : 133 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 25.34574259 Required : 28.00000000 Info(hartfock): self-consistent loop number : 134 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 25.14426893 Required : 28.00000000 Info(hartfock): self-consistent loop number : 135 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 25.34179959 Required : 28.00000000 Info(hartfock): self-consistent loop number : 136 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 25.22897855 Required : 28.00000000 Info(hartfock): self-consistent loop number : 137 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 25.28157044 Required : 28.00000000 Info(hartfock): self-consistent loop number : 138 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 25.21253777 Required : 28.00000000 Info(hartfock): self-consistent loop number : 139 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 25.29475190 Required : 28.00000000 Info(hartfock): self-consistent loop number : 140 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 25.13889454 Required : 28.00000000 Info(hartfock): self-consistent loop number : 141 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 25.36620515 Required : 28.00000000 Info(hartfock): self-consistent loop number : 142 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 25.20354115 Required : 28.00000000 Info(hartfock): self-consistent loop number : 143 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 25.31454650 Required : 28.00000000 Info(hartfock): self-consistent loop number : 144 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 25.24064924 Required : 28.00000000 Info(hartfock): self-consistent loop number : 145 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 25.27424227 Required : 28.00000000 Info(hartfock): self-consistent loop number : 146 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 25.31357063 Required : 28.00000000 Info(hartfock): self-consistent loop number : 147 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 25.25057453 Required : 28.00000000 Info(hartfock): self-consistent loop number : 148 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 25.22674023 Required : 28.00000000 Info(hartfock): self-consistent loop number : 149 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 25.26716712 Required : 28.00000000 Info(hartfock): self-consistent loop number : 150 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 25.15934122 Required : 28.00000000 Info(hartfock): self-consistent loop number : 151 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 25.17525105 Required : 28.00000000 Info(hartfock): self-consistent loop number : 152 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 25.31346344 Required : 28.00000000 Info(hartfock): self-consistent loop number : 153 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 25.23799925 Required : 28.00000000 Info(hartfock): self-consistent loop number : 154 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 25.35803918 Required : 28.00000000 Info(hartfock): self-consistent loop number : 155 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 25.30084556 Required : 28.00000000 Info(hartfock): self-consistent loop number : 156 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 25.25146936 Required : 28.00000000 Info(hartfock): self-consistent loop number : 157 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 25.46712050 Required : 28.00000000 Info(hartfock): self-consistent loop number : 158 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 25.35694566 Required : 28.00000000 Info(hartfock): self-consistent loop number : 159 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 25.29589865 Required : 28.00000000 Info(hartfock): self-consistent loop number : 160 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 25.45707757 Required : 28.00000000 Info(hartfock): self-consistent loop number : 161 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 25.11797942 Required : 28.00000000 Info(hartfock): self-consistent loop number : 162 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 25.27936990 Required : 28.00000000 Info(hartfock): self-consistent loop number : 163 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 25.40468174 Required : 28.00000000 Info(hartfock): self-consistent loop number : 164 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 25.28905480 Required : 28.00000000 Info(hartfock): self-consistent loop number : 165 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 25.28525338 Required : 28.00000000 Info(hartfock): self-consistent loop number : 166 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 25.21014246 Required : 28.00000000 Info(hartfock): self-consistent loop number : 167 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 25.25149667 Required : 28.00000000 Info(hartfock): self-consistent loop number : 168 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 25.12395989 Required : 28.00000000 Info(hartfock): self-consistent loop number : 169 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 25.28534867 Required : 28.00000000 Info(hartfock): self-consistent loop number : 170 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 25.09334858 Required : 28.00000000 Info(hartfock): self-consistent loop number : 171 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 25.25575867 Required : 28.00000000 Info(hartfock): self-consistent loop number : 172 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 25.33661043 Required : 28.00000000 Info(hartfock): self-consistent loop number : 173 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 25.32600769 Required : 28.00000000 Info(hartfock): self-consistent loop number : 174 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 25.27681193 Required : 28.00000000 Info(hartfock): self-consistent loop number : 175 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 25.32516575 Required : 28.00000000 Info(hartfock): self-consistent loop number : 176 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 25.26168755 Required : 28.00000000 Info(hartfock): self-consistent loop number : 177 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 25.25272552 Required : 28.00000000 Info(hartfock): self-consistent loop number : 178 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 25.29828215 Required : 28.00000000 Info(hartfock): self-consistent loop number : 179 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 25.15551931 Required : 28.00000000 Info(hartfock): self-consistent loop number : 180 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 25.22213734 Required : 28.00000000 Info(hartfock): self-consistent loop number : 181 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 25.23405931 Required : 28.00000000 Info(hartfock): self-consistent loop number : 182 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 25.27251189 Required : 28.00000000 Info(hartfock): self-consistent loop number : 183 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 25.29736437 Required : 28.00000000 Info(hartfock): self-consistent loop number : 184 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 25.34148706 Required : 28.00000000 Info(hartfock): self-consistent loop number : 185 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 25.33892941 Required : 28.00000000 Info(hartfock): self-consistent loop number : 186 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 25.38680879 Required : 28.00000000 Info(hartfock): self-consistent loop number : 187 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 25.10713325 Required : 28.00000000 Info(hartfock): self-consistent loop number : 188 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 25.20025484 Required : 28.00000000 Info(hartfock): self-consistent loop number : 189 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 25.33571638 Required : 28.00000000 Info(hartfock): self-consistent loop number : 190 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 25.22297936 Required : 28.00000000 Info(hartfock): self-consistent loop number : 191 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 25.30165139 Required : 28.00000000 Info(hartfock): self-consistent loop number : 192 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 25.21786029 Required : 28.00000000 Info(hartfock): self-consistent loop number : 193 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 25.28908098 Required : 28.00000000 Info(hartfock): self-consistent loop number : 194 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 25.18847106 Required : 28.00000000 Info(hartfock): self-consistent loop number : 195 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 25.35338890 Required : 28.00000000 Info(hartfock): self-consistent loop number : 196 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 25.27857756 Required : 28.00000000 Info(hartfock): self-consistent loop number : 197 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 25.18475878 Required : 28.00000000 Info(hartfock): self-consistent loop number : 198 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 25.17586016 Required : 28.00000000 Info(hartfock): self-consistent loop number : 199 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 25.40238534 Required : 28.00000000 Info(hartfock): self-consistent loop number : 200 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 25.31941994 Required : 28.00000000 Info(exxengy): 3 of 16 k-points Info(exxengy): 1 of 16 k-points Info(exxengy): 15 of 16 k-points Info(exxengy): 13 of 16 k-points Info(exxengy): 11 of 16 k-points Info(exxengy): 9 of 16 k-points Info(exxengy): 7 of 16 k-points Info(exxengy): 5 of 16 k-points Info(exxengy): 8 of 16 k-points Info(exxengy): 2 of 16 k-points Info(exxengy): 10 of 16 k-points Info(exxengy): 4 of 16 k-points Info(exxengy): 16 of 16 k-points Info(exxengy): 12 of 16 k-points Info(exxengy): 14 of 16 k-points Info(exxengy): 6 of 16 k-points Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -580.163931813 TEST_000.OUT : -578.569857365 absolute difference : 1.59407444800 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.580163931813E-02 cd tests; ./test-mpi.sh Running test in directory test_001... real 284m29.491s user 272m56.620s sys 4m5.743s + cp -rp tests.orig tests + sed -i 's#mpirun -n 4 ../../src/elk#mpiexec -np 1 ../../elk_openmpi#g' tests/test-mpi.sh + sed -i '/Failed/ a cat test.log' tests/test-mpi.sh + tee test-mpi.1_openmpi.log + /usr/bin/make test-mpi ERROR STOP Error termination. Backtrace: #0 0x7fffa4126873 in ??? #1 0x7fffa4127f43 in ??? #2 0x7fffa41299eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 3 (Cu) from 2.4000 to 1.9694 Info(checkmt): reduced muffin-tin radius of species 4 (O) from 1.8000 to 1.4770 Info(findsymcrys): atomic basis shift (lattice) : -0.5000000000 -0.5000000000 -0.5000000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 330.4323403 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 342.5645270 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 336.4868212 Required : 294.0000000 Warning(gndstate): failed to reach self-consistency after 4 loops Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 372.8017241 Required : 294.0000000 Info(elk): current task : 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 388.9004369 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 2467.014811 Required : 294.0000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 92218.57034 Required : 294.0000000 Warning(gndstate): failed to reach self-consistency after 4 loops Warning(linengy): could not find 12 linearisation energies in s.c. loop 4 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -104.8019904 -5.251500000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 75.00772939 Required : 294.0000000 Info(elk): current task : 115 Info(writeefg): electric field gradient written to EFG.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -25088.8810466 TEST_000.OUT : -17874.2780005 absolute difference : 7214.60304610 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.250888810466 Running test in directory test_002... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffb1e76873 in ??? #1 0x7fffb1e77f43 in ??? #2 0x7fffb1e799eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.3202 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 19.12034847 Required : 26.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 18.79504755 Required : 26.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 19.57081977 Required : 26.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 19.91884824 Required : 26.00000000 Warning(gndstate): failed to reach self-consistency after 5 loops Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 19.31649738 Required : 26.00000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1270.55032940 TEST_000.OUT : -1160.48937298 absolute difference : 110.060956420 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.127055032940E-01 Running test in directory test_003... ERROR STOP Error termination. Backtrace: #0 0x7fff99dd6873 in ??? #1 0x7fff99dd7f43 in ??? #2 0x7fff99dd99eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1436 Info(findsymcrys): atomic basis shift (lattice) : 0.3650000000 0.3650000000 0.3650000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.87593671 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.87428762 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.79157153 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.73858845 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.71846150 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.71292417 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.71158154 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.71182778 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.71193925 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 10 loops Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.71190932 Required : 28.00000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -580.223475286 TEST_000.OUT : -580.290032081 absolute difference : 0.665567950000E-01 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.580223475286E-02 Running test in directory test_004... ERROR STOP Error termination. Backtrace: #0 0x7fff89b76873 in ??? #1 0x7fff89b77f43 in ??? #2 0x7fff89b799eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Li) from 1.8000 to 1.7782 Info(checkmt): reduced muffin-tin radius of species 2 (F) from 2.0000 to 1.9758 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 9.121207069 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 9.129808960 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 9.226985205 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 9.313622311 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 9.432643146 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 9.525910356 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 9.570569261 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 9.568221698 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 9.568696411 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 9.568735060 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 9.568817699 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 9.568827141 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 9.568827723 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 9.568827086 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 9.568826962 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 9.568826831 Required : 12.00000000 Info(elk): current task : 120 Info(genpmat): 5 of 8 k-points Info(genpmat): 1 of 8 k-points Info(genpmat): 6 of 8 k-points Info(genpmat): 2 of 8 k-points Info(genpmat): 3 of 8 k-points Info(genpmat): 7 of 8 k-points Info(genpmat): 4 of 8 k-points Info(genpmat): 8 of 8 k-points Info(writepmat): momentum matrix elements written to file PMAT.OUT Info(elk): current task : 121 Info(dielectric): dielectric tensor written to EPSILON_ij.OUT optical conductivity written to SIGMA_ij.OUT for components i = 1, j = 1 Info(elk): current task : 180 Info(epsinv): 1 of 8 q-points Info(epsinv): 2 of 8 q-points Info(epsinv): 3 of 8 q-points Info(epsinv): 4 of 8 q-points Info(epsinv): 5 of 8 q-points Info(epsinv): 6 of 8 q-points Info(epsinv): 7 of 8 q-points Info(epsinv): 8 of 8 q-points Info(writeepsinv): inverse RPA dielectric function, eps^(-1)(G,G',q,w), written to EPSINV.OUT Info(elk): current task : 185 Info(writehmlbse): setting up BSE Hamiltonian matrix Info(hmlxbse): 33 of 64 k-points Info(hmlxbse): 1 of 64 k-points Info(hmlxbse): 2 of 64 k-points Info(hmlxbse): 34 of 64 k-points Info(hmlxbse): 3 of 64 k-points Info(hmlxbse): 35 of 64 k-points Info(hmlxbse): 4 of 64 k-points Info(hmlxbse): 36 of 64 k-points Info(hmlxbse): 5 of 64 k-points Info(hmlxbse): 37 of 64 k-points Info(hmlxbse): 6 of 64 k-points Info(hmlxbse): 38 of 64 k-points Info(hmlxbse): 7 of 64 k-points Info(hmlxbse): 39 of 64 k-points Info(hmlxbse): 8 of 64 k-points Info(hmlxbse): 40 of 64 k-points Info(hmlxbse): 9 of 64 k-points Info(hmlxbse): 41 of 64 k-points Info(hmlxbse): 10 of 64 k-points Info(hmlxbse): 42 of 64 k-points Info(hmlxbse): 11 of 64 k-points Info(hmlxbse): 43 of 64 k-points Info(hmlxbse): 12 of 64 k-points Info(hmlxbse): 44 of 64 k-points Info(hmlxbse): 13 of 64 k-points Info(hmlxbse): 45 of 64 k-points Info(hmlxbse): 14 of 64 k-points Info(hmlxbse): 46 of 64 k-points Info(hmlxbse): 15 of 64 k-points Info(hmlxbse): 47 of 64 k-points Info(hmlxbse): 16 of 64 k-points Info(hmlxbse): 48 of 64 k-points Info(hmlxbse): 17 of 64 k-points Info(hmlxbse): 49 of 64 k-points Info(hmlxbse): 18 of 64 k-points Info(hmlxbse): 50 of 64 k-points Info(hmlxbse): 19 of 64 k-points Info(hmlxbse): 51 of 64 k-points Info(hmlxbse): 20 of 64 k-points Info(hmlxbse): 52 of 64 k-points Info(hmlxbse): 53 of 64 k-points Info(hmlxbse): 21 of 64 k-points Info(hmlxbse): 54 of 64 k-points Info(hmlxbse): 22 of 64 k-points Info(hmlxbse): 55 of 64 k-points Info(hmlxbse): 23 of 64 k-points Info(hmlxbse): 56 of 64 k-points Info(hmlxbse): 24 of 64 k-points Info(hmlxbse): 57 of 64 k-points Info(hmlxbse): 25 of 64 k-points Info(hmlxbse): 58 of 64 k-points Info(hmlxbse): 26 of 64 k-points Info(hmlxbse): 59 of 64 k-points Info(hmlxbse): 27 of 64 k-points Info(hmlxbse): 60 of 64 k-points Info(hmlxbse): 28 of 64 k-points Info(hmlxbse): 61 of 64 k-points Info(hmlxbse): 29 of 64 k-points Info(hmlxbse): 62 of 64 k-points Info(hmlxbse): 30 of 64 k-points Info(hmlxbse): 31 of 64 k-points Info(hmlxbse): 63 of 64 k-points Info(hmlxbse): 32 of 64 k-points Info(hmlxbse): 64 of 64 k-points Info(hmldbse): 1 of 64 k-points Info(hmldbse): 33 of 64 k-points Info(hmldbse): 2 of 64 k-points Info(hmldbse): 34 of 64 k-points Info(hmldbse): 3 of 64 k-points Info(hmldbse): 35 of 64 k-points Info(hmldbse): 36 of 64 k-points Info(hmldbse): 4 of 64 k-points Info(hmldbse): 37 of 64 k-points Info(hmldbse): 5 of 64 k-points Info(hmldbse): 38 of 64 k-points Info(hmldbse): 6 of 64 k-points Info(hmldbse): 39 of 64 k-points Info(hmldbse): 7 of 64 k-points Info(hmldbse): 40 of 64 k-points Info(hmldbse): 8 of 64 k-points Info(hmldbse): 41 of 64 k-points Info(hmldbse): 9 of 64 k-points Info(hmldbse): 10 of 64 k-points Info(hmldbse): 42 of 64 k-points Info(hmldbse): 43 of 64 k-points Info(hmldbse): 11 of 64 k-points Info(hmldbse): 44 of 64 k-points Info(hmldbse): 12 of 64 k-points Info(hmldbse): 45 of 64 k-points Info(hmldbse): 13 of 64 k-points Info(hmldbse): 46 of 64 k-points Info(hmldbse): 14 of 64 k-points Info(hmldbse): 47 of 64 k-points Info(hmldbse): 15 of 64 k-points Info(hmldbse): 48 of 64 k-points Info(hmldbse): 16 of 64 k-points Info(hmldbse): 49 of 64 k-points Info(hmldbse): 17 of 64 k-points Info(hmldbse): 50 of 64 k-points Info(hmldbse): 18 of 64 k-points Info(hmldbse): 51 of 64 k-points Info(hmldbse): 19 of 64 k-points Info(hmldbse): 52 of 64 k-points Info(hmldbse): 20 of 64 k-points Info(hmldbse): 53 of 64 k-points Info(hmldbse): 21 of 64 k-points Info(hmldbse): 54 of 64 k-points Info(hmldbse): 22 of 64 k-points Info(hmldbse): 55 of 64 k-points Info(hmldbse): 23 of 64 k-points Info(hmldbse): 56 of 64 k-points Info(hmldbse): 24 of 64 k-points Info(hmldbse): 57 of 64 k-points Info(hmldbse): 25 of 64 k-points Info(hmldbse): 58 of 64 k-points Info(hmldbse): 26 of 64 k-points Info(hmldbse): 59 of 64 k-points Info(hmldbse): 27 of 64 k-points Info(hmldbse): 60 of 64 k-points Info(hmldbse): 28 of 64 k-points Info(hmldbse): 61 of 64 k-points Info(hmldbse): 29 of 64 k-points Info(hmldbse): 62 of 64 k-points Info(hmldbse): 30 of 64 k-points Info(hmldbse): 63 of 64 k-points Info(hmldbse): 31 of 64 k-points Info(hmldbse): 64 of 64 k-points Info(hmldbse): 32 of 64 k-points Info(writehmlbse): BSE Hamiltonian matrix written to HMLBSE.OUT Info(elk): current task : 186 Info(writeevbse): diagonalising the BSE Hamiltonian matrix Info(writeevbse): BSE eigenvectors and eigenvalues written to EVBSE.OUT BSE eigenvalues written to EIGVAL_BSE.OUT Info(elk): current task : 187 Info(dielectric_bse): dielectric tensor written to EPSILON_BSE_ij.OUT for components i = 1, j = 1 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -106.907708837 TEST_000.OUT : -107.276177255 absolute difference : 0.368468418000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.106907708837E-02 Running test in directory test_005... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.3615 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 72 The leading minor of the overlap matrix of order 29 is not positive definite Order of overlap matrix : 43 Running test in directory test_006... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.4000 to 2.2888 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.4000 to 2.2888 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 215 The leading minor of the overlap matrix of order 94 is not positive definite Order of overlap matrix : 121 Running test in directory test_007... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffa0466873 in ??? #1 0x7fffa0467f43 in ??? #2 0x7fffa04699eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.675350338 -5.434400000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 27.02068224 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 26.73808022 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.89070057 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 26.33293262 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.74033879 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.109988144 -5.434400000 for s.c. loop 6 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.75077368 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.846700232 -5.434400000 for s.c. loop 7 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.24863817 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.131446870 -5.434400000 for s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 26.83459154 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.234390387 -5.434400000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.81258228 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.494405920 -5.434400000 for s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 24.98816818 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.533906563 -5.434400000 for s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 25.82716774 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 25.96178728 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.111566091 -5.434400000 for s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 26.06622823 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.454717166 -5.434400000 for s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 25.96116868 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 25.89544825 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.908747984 -5.434400000 for s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 25.92650532 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.200305356 -5.434400000 for s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 26.00186751 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.505147761 -5.434400000 for s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 26.45291155 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -9.217801064 -5.434400000 for s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 26.54150838 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.973357824 -5.434400000 for s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 25.84695816 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.558950480 -5.434400000 for s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 25.92146466 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.904057294 -5.434400000 for s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 24.93846269 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.908400896 -5.434400000 for s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 25.16873727 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.295315613 -5.434400000 for s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 26.02273259 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.677133050 -5.434400000 for s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 26.00051090 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.517572828 -5.434400000 for s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 26.13670373 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.555185322 -5.434400000 for s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 25.76137754 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.224616604 -5.434400000 for s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 25.83871784 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.298743315 -5.434400000 for s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 25.72994584 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.919496543 -5.434400000 for s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 25.69834910 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.513232662 -5.434400000 for s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 25.60006446 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 26.41046145 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 25.94564958 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 25.80164607 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.978319287 -5.434400000 for s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 25.86819573 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.304853931 -5.434400000 for s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 25.80760604 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.929482697 -5.434400000 for s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 26.27204504 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.954777997 -5.434400000 for s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 26.19941401 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.078765975 -5.434400000 for s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 26.31314172 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.824850695 -5.434400000 for s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 26.23390394 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.427325070 -5.434400000 for s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 25.75256846 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -9.476360799 -5.434400000 for s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 26.28862837 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.878435169 -5.434400000 for s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 25.91676886 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 25.93290769 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.561677311 -5.434400000 for s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 25.84191920 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 25.21472198 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.025955748 -5.434400000 for s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 26.20895727 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.281585901 -5.434400000 for s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 25.96806037 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.095900395 -5.434400000 for s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 26.03228926 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.387920332 -5.434400000 for s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 25.92668736 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.257619348 -5.434400000 for s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 25.90769367 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 25.49202245 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.777127509 -5.434400000 for s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 25.35481431 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.004982915 -5.434400000 for s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 26.11619631 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.011870590 -5.434400000 for s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 26.19530905 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.708194290 -5.434400000 for s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 25.70115175 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 25.71914854 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 24.86030279 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 24.78880608 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 25.40876571 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.370844179 -5.434400000 for s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 25.98981626 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.774715993 -5.434400000 for s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 26.35624516 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.951916444 -5.434400000 for s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 26.00957690 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.493410749 -5.434400000 for s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 25.56060193 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.518832917 -5.434400000 for s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 25.02345190 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 25.80378317 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.013036955 -5.434400000 for s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 25.65980385 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 25.79169292 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 25.59198206 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 25.45123360 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 25.76886226 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.018037857 -5.434400000 for s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 25.70704895 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.460901933 -5.434400000 for s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 26.00843377 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.121018503 -5.434400000 for s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 25.94208735 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 24.90651877 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.480625723 -5.434400000 for s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 25.84227602 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.403387663 -5.434400000 for s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 25.85852256 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.444929050 -5.434400000 for s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 25.39118349 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.905553199 -5.434400000 for s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 25.79635101 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.926685849 -5.434400000 for s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 26.12117894 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.485559237 -5.434400000 for s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 24.53217943 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 24.86941024 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.637831687 -5.434400000 for s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 25.72227315 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.755658487 -5.434400000 for s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 25.16720022 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 25.60180124 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 26.01526840 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.989014721 -5.434400000 for s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 25.58563433 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.879870171 -5.434400000 for s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 24.89687349 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 26.26924362 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 25.77129586 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 25.86954193 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.370886774 -5.434400000 for s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 26.08966908 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 25.93369208 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.647584621 -5.434400000 for s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 25.71603408 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.848958701 -5.434400000 for s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 26.33996066 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.525749408 -5.434400000 for s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 24.51170562 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 25.12807246 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.645200073 -5.434400000 for s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 25.18223298 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 25.89558052 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 25.33416308 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 25.12676943 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.224955581 -5.434400000 for s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 25.19001435 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.013315683 -5.434400000 for s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 25.51054845 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.480939235 -5.434400000 for s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 25.43101659 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.559753493 -5.434400000 for s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 25.20536155 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.002744880 -5.434400000 for s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 26.01091162 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.866870771 -5.434400000 for s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 25.74923070 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 25.78072521 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 25.28744342 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 25.05749784 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.819190189 -5.434400000 for s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 25.11379141 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.722807952 -5.434400000 for s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 26.28950747 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 25.31535486 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 25.53282055 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.829702167 -5.434400000 for s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 25.63045883 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.012316270 -5.434400000 for s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 25.60131084 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 25.62708178 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.592435130 -5.434400000 for s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 24.85173283 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.131216399 -5.434400000 for s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 25.94977990 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.253787375 -5.434400000 for s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 25.81668223 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.552716256 -5.434400000 for s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 26.26113177 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.520222358 -5.434400000 for s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 26.13530800 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.484439614 -5.434400000 for s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 25.97804107 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 25.22614652 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.005170508 -5.434400000 for s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 25.74110622 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 25.10246868 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.531246666 -5.434400000 for s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 25.47748910 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.542073648 -5.434400000 for s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 25.97338298 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 25.40987326 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.508105424 -5.434400000 for s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 25.85405570 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 25.64963950 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 25.78152406 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 25.71908496 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.527107988 -5.434400000 for s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 25.55795324 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -10.74843025 -5.434400000 for s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 26.24582441 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 26.34726824 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.360504951 -5.434400000 for s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 26.08431047 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.341849824 -5.434400000 for s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 25.96142413 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.973450273 -5.434400000 for s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 26.23881264 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 25.23213253 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.078238794 -5.434400000 for s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 25.46972419 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 25.12485403 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.652909992 -5.434400000 for s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 24.57512929 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 25.46698025 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 25.85911920 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 25.25749343 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 24.57815121 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 26.06891803 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.571363899 -5.434400000 for s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 26.75259724 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 26.29174572 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.454828232 -5.434400000 for s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 25.98240852 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.492302204 -5.434400000 for s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 26.02519744 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.313704730 -5.434400000 for s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 25.54967723 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 25.78290891 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.546214226 -5.434400000 for s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 26.56181146 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 26.13366274 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 26.47553312 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 25.70171311 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.267754215 -5.434400000 for s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 25.75743903 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.218574058 -5.434400000 for s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 25.81581897 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.663733882 -5.434400000 for s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 25.92334404 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.662326379 -5.434400000 for s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 26.27859678 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 26.13056723 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 25.67073405 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 25.17648295 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.044373063 -5.434400000 for s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 25.16379327 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.491961971 -5.434400000 for s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 25.67366007 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 25.31766631 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.213039176 -5.434400000 for s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 25.76809791 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 25.56716491 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 25.50491039 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.400147682 -5.434400000 for s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 25.70384555 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.735724473 -5.434400000 for s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 25.99546041 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.033515630 -5.434400000 for s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 25.82854713 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.808319372 -5.434400000 for s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 25.18119593 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.308595595 -5.434400000 for s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 25.41554857 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.007629829 -5.434400000 for s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 26.15729108 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.366826666 -5.434400000 for s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 25.10580556 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.941559224 -5.434400000 for s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 25.23315106 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.966053224 -5.434400000 for s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 24.67064144 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 26.13276565 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.260197641 -5.434400000 for s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 24.95976760 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.743266986 -5.434400000 for s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 26.04938597 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 26.47949296 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.026266294 -5.434400000 for s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 25.16418485 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 25.14416112 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.537723611 -5.434400000 for s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 25.96579504 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 25.77431369 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 24.57253780 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.364630087 -5.434400000 for s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 25.69748744 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.303264482 -5.434400000 for s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 26.03817236 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 26.17312141 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.441474514 -5.434400000 for s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 25.94053867 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.905065865 -5.434400000 for s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 25.96477638 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.900189316 -5.434400000 for s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 26.37150627 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.485684423 -5.434400000 for s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 26.17355250 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.335549957 -5.434400000 for s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 25.93622027 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 25.70426924 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.298002931 -5.434400000 for s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 25.21311552 Required : 39.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 25.91769131 Required : 39.00000000 Info(elk): current task : 15 Info(writelsj): muffin-tin L, S and J expectation values written to LSJ.OUT Info(elk): current task : 16 Info(writelsj): muffin-tin L, S and J expectation values for each k-point and state in kstlist written to LSJ_KST.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1515.75083630 TEST_000.OUT : -1534.82264036 absolute difference : 19.0718040600 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.151575083630E-01 Running test in directory test_008... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff96966873 in ??? #1 0x7fff96967f43 in ??? #2 0x7fff969699eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 37.79254722 Required : 52.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 34.96575598 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.592749181 -5.434400000 for s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 34.37412801 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.788212809 -5.434400000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 34.49575451 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.681723924 -5.434400000 for s.c. loop 5 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 34.91143411 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -10.79834654 -5.434400000 for s.c. loop 6 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 34.94015491 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -10.90444338 -5.434400000 for s.c. loop 7 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 33.72935919 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 39.73644421 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 9 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -24.29333399 -5.434400000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 72.82226897 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 38.45394829 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 37.31087727 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 12 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -21.77794254 -5.434400000 for s.c. loop 12 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 65.35975920 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 37.20371294 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 38.26497175 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 15 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -640497.0245 -5.434400000 for s.c. loop 15 Warning(occupy): could not find Fermi energy Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 643960.9867 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 16 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -110522.4619 -5.434400000 for s.c. loop 16 Warning(occupy): could not find Fermi energy Warning(occupy): not enough empty states for k-point 1 and s.c. loop 16 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 16 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 16 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 16 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 16 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 16 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 16 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 16.79114261 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 17 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -69567.95189 -5.434400000 for s.c. loop 17 Warning(occupy): could not find Fermi energy Warning(occupy): not enough empty states for k-point 1 and s.c. loop 17 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 17 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 17 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 17 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 17 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 12.37497446 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 18 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -38203.57826 -5.434400000 for s.c. loop 18 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 18 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 18 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 18 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 18 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 18 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 18 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 20.26488879 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 19 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -18836.86751 -5.434400000 for s.c. loop 19 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 19 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 19 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 19 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 19 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 19 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 15.42742470 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 20 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -3137.016876 -5.434400000 for s.c. loop 20 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 20 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 20 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 20 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 20 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 20 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 17.28720104 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 21 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -1042.169616 -5.434400000 for s.c. loop 21 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 21 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 21 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 21 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 21 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 21 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 21 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 21 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 16.66529880 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 22 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -697.0173111 -5.434400000 for s.c. loop 22 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 22 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 22 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 22 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 22 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 3.429754337 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 23 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -595.2884625 -5.434400000 for s.c. loop 23 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 23 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 23 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 0.4671433159 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 24 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -252.3479203 -5.434400000 for s.c. loop 24 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 24 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 24 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 1.088554517 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 25 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5424.076728 -5.434400000 for s.c. loop 25 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 25 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 25 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 25 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 25 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 25 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 25 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 25 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 25 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 25 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 52.66756647 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 26 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -61.79996284 -5.434400000 for s.c. loop 26 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 26 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 26 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 26 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 1.421111348 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 27 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -24.70312052 -5.434400000 for s.c. loop 27 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 27 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 7.274360124 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 28 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.830566733 -5.434400000 for s.c. loop 28 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 28 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 28 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 28 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 28 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 28 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 28 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 28 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 28 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 28 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 38.85973633 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -22.86927690 -5.434400000 for s.c. loop 29 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 29 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 47.41284326 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 30 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -874.9109673 -5.434400000 for s.c. loop 30 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 30 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 30 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 30 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 47.84413082 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 31 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -43.02567330 -5.434400000 for s.c. loop 31 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 31 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 31 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 31 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 31 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 38.89346553 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 32 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -123.2071016 -5.434400000 for s.c. loop 32 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 32 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 32 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 32 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 32 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 32 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 32 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 32 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 32 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 32 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 34.82352555 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 33 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -1621.056343 -5.434400000 for s.c. loop 33 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 33 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 33 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 33 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 33 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 33 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 33 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 33 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 33 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 33 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 40.69040462 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 34 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -43.71391293 -5.434400000 for s.c. loop 34 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 34 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 34 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 34 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 34 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 34 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 34 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 34 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 34 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 34 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 37.98699764 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 35 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -185.1199716 -5.434400000 for s.c. loop 35 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 35 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 35 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 35 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 35 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 35 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 35 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 35 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 35 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 35 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 41.93334135 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 36 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -91.72802981 -5.434400000 for s.c. loop 36 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 36 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 36 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 36 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 36 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 36 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 36 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 36 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 36 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 36 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 39.61811605 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 37 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -106.5583282 -5.434400000 for s.c. loop 37 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 37 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 37 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 37 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 37 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 37 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 37 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 37 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 37 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 37 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 40.68056777 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 38 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -105.3821777 -5.434400000 for s.c. loop 38 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 38 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 38 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 38 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 38 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 38 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 38 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 38 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 38 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 38 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 40.20003518 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 39 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -111.8195420 -5.434400000 for s.c. loop 39 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 39 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 39 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 39 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 39 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 39 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 39 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 39 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 39 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 39 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 40.05781158 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 40 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -120.5797488 -5.434400000 for s.c. loop 40 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 40 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 40 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 40 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 40 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 40 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 40 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 40 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 40 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 40 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 40.68503420 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 41 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -109.8531461 -5.434400000 for s.c. loop 41 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 41 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 41 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 41 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 41 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 41 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 41 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 41 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 41 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 41 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 40.40825133 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 42 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -109.0166156 -5.434400000 for s.c. loop 42 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 42 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 42 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 42 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 42 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 42 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 42 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 42 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 42 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 42 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 40.09232984 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 43 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -113.2590008 -5.434400000 for s.c. loop 43 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 43 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 43 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 43 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 43 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 43 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 43 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 43 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 43 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 43 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 40.44080508 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 44 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -109.0800298 -5.434400000 for s.c. loop 44 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 44 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 44 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 44 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 44 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 44 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 44 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 44 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 44 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 44 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 40.01771716 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -115.3938760 -5.434400000 for s.c. loop 45 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 45 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 45 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 45 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 45 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 45 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 45 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 45 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 45 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 45 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 40.71400097 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 46 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -109.9060883 -5.434400000 for s.c. loop 46 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 46 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 46 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 46 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 46 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 46 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 46 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 46 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 46 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 46 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 40.05969434 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -112.6756508 -5.434400000 for s.c. loop 47 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 47 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 47 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 47 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 47 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 47 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 47 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 47 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 47 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 47 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 40.33411256 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 48 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -112.0316408 -5.434400000 for s.c. loop 48 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 48 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 48 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 48 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 48 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 48 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 48 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 48 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 48 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 48 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 40.03544164 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 49 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -114.7171688 -5.434400000 for s.c. loop 49 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 40.06522955 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 50 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -116.7838568 -5.434400000 for s.c. loop 50 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 50 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 50 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 50 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 50 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 50 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 50 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 50 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 50 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 50 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 39.56952422 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 51 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -141.4544933 -5.434400000 for s.c. loop 51 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 51 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 51 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 51 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 51 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 51 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 51 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 51 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 51 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 51 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 39.90226458 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 52 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -145.3768600 -5.434400000 for s.c. loop 52 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 52 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 52 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 52 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 52 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 52 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 52 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 52 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 52 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 52 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 40.18122151 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 53 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -138.7504084 -5.434400000 for s.c. loop 53 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 53 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 53 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 53 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 53 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 53 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 53 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 53 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 53 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 53 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 40.02887891 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -143.2793407 -5.434400000 for s.c. loop 54 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 54 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 54 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 54 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 54 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 54 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 54 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 54 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 54 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 54 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 40.28321234 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 55 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -138.3751661 -5.434400000 for s.c. loop 55 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 55 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 55 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 55 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 55 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 55 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 55 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 55 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 55 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 55 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 39.94646893 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 56 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -138.8809870 -5.434400000 for s.c. loop 56 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 56 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 56 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 56 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 56 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 56 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 56 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 56 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 56 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 56 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 40.20414899 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 57 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -137.3960412 -5.434400000 for s.c. loop 57 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 39.80760407 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 58 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -136.2551931 -5.434400000 for s.c. loop 58 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 58 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 58 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 58 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 58 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 58 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 58 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 58 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 58 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 58 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 39.92421361 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 59 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -139.3397707 -5.434400000 for s.c. loop 59 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 59 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 59 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 59 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 59 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 59 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 59 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 59 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 59 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 59 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 40.27406360 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -134.6458549 -5.434400000 for s.c. loop 60 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 60 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 60 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 60 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 60 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 60 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 60 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 60 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 60 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 60 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 40.13771410 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -132.0310879 -5.434400000 for s.c. loop 61 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 61 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 61 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 61 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 61 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 61 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 61 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 61 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 61 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 61 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 40.33775875 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -123.1736388 -5.434400000 for s.c. loop 62 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 62 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 62 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 62 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 62 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 62 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 62 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 62 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 62 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 62 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 39.97648766 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -129.1758816 -5.434400000 for s.c. loop 63 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 63 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 63 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 63 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 63 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 63 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 63 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 63 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 63 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 63 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 39.89996382 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -135.3080819 -5.434400000 for s.c. loop 64 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 64 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 64 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 64 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 64 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 64 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 64 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 64 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 64 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 64 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 39.80766163 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -154.6222705 -5.434400000 for s.c. loop 65 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 65 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 65 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 65 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 65 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 65 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 65 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 65 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 65 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 65 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 39.80265157 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -168.6145763 -5.434400000 for s.c. loop 66 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 66 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 66 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 66 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 66 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 66 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 66 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 66 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 66 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 66 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 40.71981017 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -129.4086636 -5.434400000 for s.c. loop 67 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 67 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 67 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 67 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 67 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 67 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 67 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 67 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 67 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 67 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 40.03833892 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -135.7103685 -5.434400000 for s.c. loop 68 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 68 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 68 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 68 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 68 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 68 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 68 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 68 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 68 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 68 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 40.13619876 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -133.7692887 -5.434400000 for s.c. loop 69 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 69 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 69 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 69 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 69 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 69 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 69 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 69 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 69 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 69 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 40.10742524 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -136.6926566 -5.434400000 for s.c. loop 70 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 70 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 70 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 70 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 70 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 70 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 70 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 70 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 70 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 70 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 40.29960739 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -132.5494697 -5.434400000 for s.c. loop 71 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 71 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 71 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 71 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 71 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 71 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 71 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 71 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 71 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 71 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 40.43777129 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -126.1001718 -5.434400000 for s.c. loop 72 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 72 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 72 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 72 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 72 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 72 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 72 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 72 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 72 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 72 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 39.76905171 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -135.7457657 -5.434400000 for s.c. loop 73 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 73 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 73 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 73 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 73 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 73 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 73 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 73 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 73 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 73 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 39.91965490 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -145.2532797 -5.434400000 for s.c. loop 74 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 74 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 74 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 74 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 74 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 74 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 74 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 74 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 74 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 74 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 40.17879931 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -141.6176552 -5.434400000 for s.c. loop 75 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 75 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 75 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 75 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 75 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 75 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 75 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 75 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 75 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 75 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 40.06727152 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -141.8205548 -5.434400000 for s.c. loop 76 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 76 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 76 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 76 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 76 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 76 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 76 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 76 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 76 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 76 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 39.71484242 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -152.0934517 -5.434400000 for s.c. loop 77 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 77 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 77 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 77 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 77 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 77 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 77 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 77 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 77 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 77 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 40.22152823 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -147.7312298 -5.434400000 for s.c. loop 78 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 78 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 78 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 78 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 78 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 78 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 78 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 78 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 78 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 78 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 40.19569178 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -139.9266685 -5.434400000 for s.c. loop 79 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 79 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 79 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 79 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 79 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 79 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 79 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 79 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 79 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 79 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 40.12141164 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -140.7754394 -5.434400000 for s.c. loop 80 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 80 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 80 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 80 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 80 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 80 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 80 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 80 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 80 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 80 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 40.09693709 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -147.5138974 -5.434400000 for s.c. loop 81 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 81 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 81 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 81 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 81 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 81 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 81 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 81 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 81 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 81 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 39.91947314 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -146.3345711 -5.434400000 for s.c. loop 82 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 82 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 82 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 82 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 82 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 82 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 82 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 82 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 82 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 82 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 39.98745768 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -150.2019398 -5.434400000 for s.c. loop 83 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 83 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 83 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 83 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 83 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 83 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 83 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 83 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 83 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 83 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 40.41419031 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -141.4540243 -5.434400000 for s.c. loop 84 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 84 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 84 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 84 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 84 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 84 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 84 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 84 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 84 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 84 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 40.30708822 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -131.1827891 -5.434400000 for s.c. loop 85 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 85 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 85 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 85 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 85 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 85 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 85 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 85 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 85 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 85 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 39.89760605 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -138.7664954 -5.434400000 for s.c. loop 86 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 86 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 86 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 86 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 86 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 86 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 86 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 86 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 86 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 86 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 40.42328516 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -137.4669385 -5.434400000 for s.c. loop 87 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 87 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 87 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 87 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 87 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 87 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 87 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 87 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 87 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 87 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 40.61146876 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -128.9540066 -5.434400000 for s.c. loop 88 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 88 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 88 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 88 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 88 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 88 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 88 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 88 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 88 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 88 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 40.43639023 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -121.8637521 -5.434400000 for s.c. loop 89 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 89 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 89 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 89 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 89 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 89 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 89 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 89 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 89 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 89 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 39.88932795 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -135.5708097 -5.434400000 for s.c. loop 90 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 90 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 90 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 90 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 90 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 90 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 90 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 90 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 90 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 90 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 39.99924009 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -142.3560029 -5.434400000 for s.c. loop 91 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 91 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 91 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 91 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 91 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 91 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 91 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 91 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 91 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 91 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 40.55866403 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -135.7174518 -5.434400000 for s.c. loop 92 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 92 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 92 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 92 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 92 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 92 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 92 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 92 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 92 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 92 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 40.35440458 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -126.7455544 -5.434400000 for s.c. loop 93 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 93 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 93 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 93 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 93 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 93 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 93 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 93 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 93 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 93 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 40.14186992 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -133.8203173 -5.434400000 for s.c. loop 94 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 94 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 94 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 94 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 94 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 94 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 94 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 94 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 94 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 94 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 39.87984756 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -148.8309383 -5.434400000 for s.c. loop 95 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 95 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 95 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 95 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 95 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 95 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 95 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 95 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 95 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 95 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 40.69298653 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -132.5566107 -5.434400000 for s.c. loop 96 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 96 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 96 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 96 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 96 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 96 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 96 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 96 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 96 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 96 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 39.89032910 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -141.1182352 -5.434400000 for s.c. loop 97 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 97 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 97 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 97 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 97 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 97 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 97 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 97 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 97 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 97 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 40.39235938 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -137.2919331 -5.434400000 for s.c. loop 98 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 98 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 98 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 98 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 98 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 98 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 98 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 98 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 98 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 98 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 39.74109205 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -144.0641261 -5.434400000 for s.c. loop 99 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 99 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 99 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 99 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 99 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 99 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 99 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 99 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 99 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 99 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 40.53893388 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -137.1042542 -5.434400000 for s.c. loop 100 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 100 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 100 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 100 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 100 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 100 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 100 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 100 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 100 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 100 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 40.10195347 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -141.1903485 -5.434400000 for s.c. loop 101 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 101 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 101 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 101 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 101 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 101 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 101 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 101 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 101 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 101 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 40.22519415 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -142.4494215 -5.434400000 for s.c. loop 102 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 102 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 102 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 102 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 102 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 102 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 102 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 102 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 102 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 102 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 39.79677667 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -158.7318759 -5.434400000 for s.c. loop 103 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 103 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 103 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 103 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 103 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 103 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 103 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 103 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 103 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 103 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 40.14877935 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -155.1283289 -5.434400000 for s.c. loop 104 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 104 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 104 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 104 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 104 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 104 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 104 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 104 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 104 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 104 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 39.63809534 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -165.0468391 -5.434400000 for s.c. loop 105 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 105 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 105 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 105 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 105 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 105 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 105 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 105 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 105 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 105 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 40.01976297 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -166.0883691 -5.434400000 for s.c. loop 106 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 106 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 106 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 106 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 106 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 106 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 106 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 106 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 106 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 106 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 40.03013985 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -165.4400783 -5.434400000 for s.c. loop 107 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 107 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 107 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 107 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 107 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 107 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 107 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 107 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 107 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 107 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 40.14938933 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -160.2528965 -5.434400000 for s.c. loop 108 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 108 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 108 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 108 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 108 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 108 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 108 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 108 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 108 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 108 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 39.66051936 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -171.5913896 -5.434400000 for s.c. loop 109 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 109 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 109 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 109 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 109 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 109 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 109 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 109 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 109 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 109 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 39.64166865 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -193.4747853 -5.434400000 for s.c. loop 110 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 110 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 110 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 110 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 110 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 110 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 110 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 110 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 110 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 110 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 39.75808266 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -192.0841411 -5.434400000 for s.c. loop 111 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 111 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 111 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 111 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 111 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 111 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 111 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 111 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 111 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 111 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 40.10542855 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -170.3612011 -5.434400000 for s.c. loop 112 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 112 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 112 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 112 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 112 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 112 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 112 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 112 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 112 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 112 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 40.19176597 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -158.9175426 -5.434400000 for s.c. loop 113 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 113 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 113 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 113 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 113 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 113 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 113 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 113 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 113 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 113 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 40.04187238 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -160.6808165 -5.434400000 for s.c. loop 114 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 40.15630374 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -152.0679407 -5.434400000 for s.c. loop 115 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 115 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 115 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 115 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 115 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 115 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 115 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 115 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 115 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 115 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 40.08190813 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -155.2443680 -5.434400000 for s.c. loop 116 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 116 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 116 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 116 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 116 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 116 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 116 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 116 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 116 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 116 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 39.43466322 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -178.8680769 -5.434400000 for s.c. loop 117 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 117 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 117 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 117 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 117 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 117 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 117 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 117 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 117 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 117 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 39.80139361 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -174.4489079 -5.434400000 for s.c. loop 118 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 118 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 118 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 118 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 118 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 118 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 118 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 118 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 118 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 118 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 39.94735303 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -167.2358468 -5.434400000 for s.c. loop 119 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 119 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 119 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 119 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 119 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 119 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 119 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 119 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 119 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 119 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 39.57699164 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -176.5264452 -5.434400000 for s.c. loop 120 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 120 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 120 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 120 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 120 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 120 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 120 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 120 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 120 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 120 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 40.09399798 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -175.1655812 -5.434400000 for s.c. loop 121 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 121 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 121 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 121 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 121 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 121 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 121 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 121 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 121 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 121 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 39.62068662 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -180.4875570 -5.434400000 for s.c. loop 122 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 122 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 122 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 122 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 122 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 122 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 122 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 122 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 122 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 122 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 40.43782693 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -167.8615774 -5.434400000 for s.c. loop 123 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 123 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 123 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 123 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 123 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 123 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 123 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 123 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 123 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 123 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 39.53552574 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -175.2837177 -5.434400000 for s.c. loop 124 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 124 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 124 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 124 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 124 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 124 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 124 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 124 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 124 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 124 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 39.59017790 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -176.0516762 -5.434400000 for s.c. loop 125 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 125 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 125 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 125 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 125 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 125 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 125 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 125 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 125 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 125 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 40.46592151 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -155.6768417 -5.434400000 for s.c. loop 126 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 126 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 126 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 126 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 126 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 126 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 126 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 126 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 126 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 126 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 39.84398815 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -155.1437433 -5.434400000 for s.c. loop 127 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 127 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 127 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 127 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 127 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 127 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 127 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 127 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 127 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 127 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 39.50787014 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -164.1986708 -5.434400000 for s.c. loop 128 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 128 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 128 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 128 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 128 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 128 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 128 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 128 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 128 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 128 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 39.78204114 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -158.6900378 -5.434400000 for s.c. loop 129 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 129 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 129 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 129 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 129 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 129 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 129 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 129 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 129 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 129 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 39.91574203 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -157.1229531 -5.434400000 for s.c. loop 130 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 130 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 130 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 130 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 130 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 130 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 130 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 130 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 130 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 130 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 39.58859119 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -167.2120472 -5.434400000 for s.c. loop 131 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 131 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 131 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 131 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 131 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 131 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 131 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 131 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 131 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 131 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 40.12674277 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -160.7774173 -5.434400000 for s.c. loop 132 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 132 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 132 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 132 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 132 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 132 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 132 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 132 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 132 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 132 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 39.89099917 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -149.0185597 -5.434400000 for s.c. loop 133 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 133 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 133 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 133 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 133 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 133 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 133 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 133 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 133 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 133 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 40.04185527 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -132.3690424 -5.434400000 for s.c. loop 134 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 134 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 134 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 134 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 134 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 134 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 134 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 134 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 134 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 134 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 39.95895248 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -136.8733447 -5.434400000 for s.c. loop 135 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 135 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 135 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 135 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 135 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 135 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 135 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 135 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 135 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 135 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 39.88571047 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -157.0783163 -5.434400000 for s.c. loop 136 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 136 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 136 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 136 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 136 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 136 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 136 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 136 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 136 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 136 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 39.77662147 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -173.8625218 -5.434400000 for s.c. loop 137 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 137 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 137 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 137 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 137 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 137 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 137 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 137 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 137 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 137 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 39.63568925 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -187.9334430 -5.434400000 for s.c. loop 138 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 138 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 138 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 138 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 138 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 138 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 138 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 138 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 138 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 138 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 40.30219676 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -163.0301159 -5.434400000 for s.c. loop 139 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 139 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 139 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 139 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 139 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 139 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 139 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 139 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 139 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 139 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 39.76445220 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -161.6399356 -5.434400000 for s.c. loop 140 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 140 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 140 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 140 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 140 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 140 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 140 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 140 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 140 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 140 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 39.97593967 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -161.1315133 -5.434400000 for s.c. loop 141 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 141 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 141 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 141 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 141 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 141 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 141 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 141 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 141 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 141 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 39.53528538 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -170.4800768 -5.434400000 for s.c. loop 142 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 142 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 142 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 142 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 142 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 142 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 142 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 142 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 142 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 142 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 39.57507683 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -174.4204488 -5.434400000 for s.c. loop 143 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 143 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 143 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 143 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 143 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 143 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 143 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 143 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 143 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 143 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 39.30927096 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -201.2053102 -5.434400000 for s.c. loop 144 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 144 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 144 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 144 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 144 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 144 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 144 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 144 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 144 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 144 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 39.94727509 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -178.8955478 -5.434400000 for s.c. loop 145 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 145 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 145 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 145 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 145 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 145 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 145 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 145 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 145 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 145 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 39.90258261 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -169.7557711 -5.434400000 for s.c. loop 146 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 146 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 146 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 146 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 146 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 146 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 146 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 146 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 146 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 146 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 39.72420212 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -165.9214258 -5.434400000 for s.c. loop 147 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 147 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 147 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 147 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 147 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 147 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 147 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 147 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 147 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 147 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 40.16982139 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -137.3768337 -5.434400000 for s.c. loop 148 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 148 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 148 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 148 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 148 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 148 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 148 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 148 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 148 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 148 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 39.92475920 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -150.0052310 -5.434400000 for s.c. loop 149 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 149 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 149 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 149 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 149 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 149 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 149 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 149 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 149 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 149 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 39.60796846 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -174.1999128 -5.434400000 for s.c. loop 150 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 150 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 150 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 150 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 150 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 150 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 150 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 150 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 150 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 150 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 39.78279928 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -172.4771292 -5.434400000 for s.c. loop 151 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 151 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 151 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 151 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 151 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 151 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 151 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 151 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 151 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 151 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 39.84322300 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -161.4047188 -5.434400000 for s.c. loop 152 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 152 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 152 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 152 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 152 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 152 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 152 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 152 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 152 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 152 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 39.49920314 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -178.0653791 -5.434400000 for s.c. loop 153 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 153 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 153 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 153 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 153 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 153 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 153 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 153 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 153 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 153 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 40.52256311 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -156.6344589 -5.434400000 for s.c. loop 154 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 154 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 154 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 154 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 154 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 154 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 154 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 154 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 154 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 154 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 39.58399711 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -163.5566842 -5.434400000 for s.c. loop 155 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 155 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 155 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 155 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 155 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 155 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 155 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 155 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 155 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 155 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 40.14523115 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -162.4422297 -5.434400000 for s.c. loop 156 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 156 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 156 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 156 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 156 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 156 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 156 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 156 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 156 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 156 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 40.55401846 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -147.8664337 -5.434400000 for s.c. loop 157 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 157 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 157 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 157 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 157 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 157 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 157 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 157 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 157 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 157 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 40.25496717 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -135.4469286 -5.434400000 for s.c. loop 158 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 158 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 158 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 158 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 158 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 158 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 158 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 158 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 158 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 158 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 40.16696563 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -133.1030954 -5.434400000 for s.c. loop 159 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 159 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 159 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 159 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 159 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 159 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 159 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 159 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 159 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 159 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 39.41127460 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -157.9640631 -5.434400000 for s.c. loop 160 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 160 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 160 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 160 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 160 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 160 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 160 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 160 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 160 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 160 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 40.39936011 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -151.0215547 -5.434400000 for s.c. loop 161 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 161 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 161 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 161 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 161 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 161 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 161 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 161 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 161 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 161 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 39.88592229 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -152.9296597 -5.434400000 for s.c. loop 162 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 162 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 162 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 162 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 162 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 162 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 162 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 162 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 162 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 162 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 39.89176195 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -156.4561337 -5.434400000 for s.c. loop 163 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 163 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 163 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 163 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 163 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 163 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 163 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 163 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 163 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 163 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 39.66648702 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -169.1250104 -5.434400000 for s.c. loop 164 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 164 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 164 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 164 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 164 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 164 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 164 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 164 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 164 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 164 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 39.85781558 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -178.7484365 -5.434400000 for s.c. loop 165 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 165 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 165 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 165 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 165 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 165 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 165 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 165 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 165 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 165 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 39.77572909 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -203.9295935 -5.434400000 for s.c. loop 166 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 166 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 166 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 166 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 166 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 166 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 166 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 166 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 166 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 166 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 40.27926490 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -165.1548958 -5.434400000 for s.c. loop 167 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 167 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 167 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 167 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 167 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 167 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 167 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 167 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 167 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 167 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 40.02272863 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -168.9176332 -5.434400000 for s.c. loop 168 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 168 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 168 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 168 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 168 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 168 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 168 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 168 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 168 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 168 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 39.81312610 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -185.7191592 -5.434400000 for s.c. loop 169 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 169 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 169 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 169 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 169 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 169 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 169 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 169 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 169 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 169 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 40.05916948 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -181.0466123 -5.434400000 for s.c. loop 170 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 170 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 170 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 170 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 170 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 170 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 170 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 170 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 170 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 170 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 39.87359110 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -174.2468497 -5.434400000 for s.c. loop 171 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 171 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 171 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 171 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 171 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 171 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 171 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 171 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 171 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 171 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 39.69278179 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -182.4898800 -5.434400000 for s.c. loop 172 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 172 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 172 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 172 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 172 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 172 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 172 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 172 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 172 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 172 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 40.17636237 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -173.7397137 -5.434400000 for s.c. loop 173 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 173 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 173 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 173 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 173 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 173 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 173 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 173 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 173 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 173 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 40.07541693 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -170.7821354 -5.434400000 for s.c. loop 174 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 174 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 174 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 174 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 174 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 174 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 174 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 174 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 174 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 174 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 40.22208129 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -165.5459147 -5.434400000 for s.c. loop 175 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 175 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 175 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 175 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 175 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 175 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 175 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 175 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 175 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 175 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 39.48331810 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -187.7209147 -5.434400000 for s.c. loop 176 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 176 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 176 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 176 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 176 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 176 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 176 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 176 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 176 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 176 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 39.45076918 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -199.3622753 -5.434400000 for s.c. loop 177 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 177 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 177 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 177 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 177 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 177 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 177 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 177 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 177 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 177 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 39.93125067 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -193.2836668 -5.434400000 for s.c. loop 178 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 178 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 178 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 178 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 178 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 178 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 178 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 178 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 178 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 178 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 39.35073982 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -199.8812772 -5.434400000 for s.c. loop 179 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 179 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 179 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 179 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 179 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 179 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 179 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 179 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 179 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 179 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 39.80937959 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -195.3306408 -5.434400000 for s.c. loop 180 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 180 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 180 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 180 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 180 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 180 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 180 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 180 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 180 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 180 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 39.60152165 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -200.4621944 -5.434400000 for s.c. loop 181 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 181 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 181 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 181 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 181 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 181 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 181 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 181 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 181 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 181 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 39.46631038 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -204.9901264 -5.434400000 for s.c. loop 182 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 182 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 182 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 182 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 182 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 182 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 182 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 182 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 182 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 182 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 39.91136022 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -202.5337272 -5.434400000 for s.c. loop 183 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 183 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 183 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 183 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 183 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 183 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 183 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 183 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 183 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 183 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 39.81991534 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -197.9095165 -5.434400000 for s.c. loop 184 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 184 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 184 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 184 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 184 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 184 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 184 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 184 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 184 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 184 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 39.25854605 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -211.7365150 -5.434400000 for s.c. loop 185 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 185 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 185 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 185 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 185 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 185 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 185 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 185 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 185 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 185 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 40.53905119 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -192.7998950 -5.434400000 for s.c. loop 186 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 186 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 186 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 186 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 186 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 186 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 186 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 186 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 186 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 186 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 39.28919026 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -207.3397891 -5.434400000 for s.c. loop 187 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 187 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 187 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 187 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 187 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 187 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 187 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 187 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 187 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 187 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 40.06914058 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -199.2577519 -5.434400000 for s.c. loop 188 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 188 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 188 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 188 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 188 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 188 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 188 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 188 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 188 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 188 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 39.66616168 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -195.6574446 -5.434400000 for s.c. loop 189 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 189 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 189 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 189 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 189 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 189 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 189 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 189 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 189 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 189 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 39.27466922 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -205.7502172 -5.434400000 for s.c. loop 190 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 190 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 190 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 190 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 190 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 190 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 190 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 190 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 190 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 190 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 39.60685333 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -204.5786107 -5.434400000 for s.c. loop 191 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 191 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 191 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 191 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 191 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 191 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 191 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 191 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 191 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 191 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 39.69278823 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -200.1787646 -5.434400000 for s.c. loop 192 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 192 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 192 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 192 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 192 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 192 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 192 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 192 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 192 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 192 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 39.94869101 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -196.7342711 -5.434400000 for s.c. loop 193 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 193 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 193 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 193 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 193 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 193 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 193 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 193 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 193 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 193 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 40.27162925 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -157.5147247 -5.434400000 for s.c. loop 194 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 194 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 194 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 194 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 194 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 194 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 194 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 194 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 194 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 194 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 39.55311329 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -178.2434570 -5.434400000 for s.c. loop 195 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 195 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 195 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 195 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 195 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 195 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 195 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 195 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 195 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 195 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 39.90838915 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -175.2901429 -5.434400000 for s.c. loop 196 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 196 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 196 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 196 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 196 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 196 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 196 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 196 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 196 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 196 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 39.81262153 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -176.3784459 -5.434400000 for s.c. loop 197 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 197 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 197 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 197 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 197 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 197 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 197 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 197 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 197 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 197 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 40.07221743 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -173.1591059 -5.434400000 for s.c. loop 198 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 198 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 198 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 198 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 198 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 198 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 198 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 198 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 198 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 198 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 39.89725312 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -170.1421197 -5.434400000 for s.c. loop 199 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 199 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 199 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 199 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 199 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 199 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 199 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 199 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 199 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 199 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 39.87212051 Required : 52.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -168.7496511 -5.434400000 for s.c. loop 200 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 200 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 200 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 200 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 200 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 200 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 200 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 200 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 200 Warning(occupy): not enough empty states for k-point 9 and s.c. loop 200 Warning(occupy): not enough empty states for k-point 10 and s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 39.87830425 Required : 52.00000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -2540.92552965 TEST_000.OUT : -1949.31320088 absolute difference : 591.612328770 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.254092552965E-01 Running test in directory test_009... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (B) from 1.8000 to 1.6129 Info(checkmt): reduced muffin-tin radius of species 2 (N+) from 1.4500 to 1.2993 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 243 The leading minor of the overlap matrix of order 115 is not positive definite Order of overlap matrix : 128 Running test in directory test_010... ERROR STOP Error termination. Backtrace: #0 0x7fffb29c6873 in ??? #1 0x7fffb29c7f43 in ??? #2 0x7fffb29c99eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (O) from 1.8000 to 0.9906 Info(checkmt): reduced muffin-tin radius of species 2 (H) from 1.4000 to 0.7704 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 8.727117532 Required : 10.00000000 Warning(gndstate): failed to reach self-consistency after 2 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 7.893320246 Required : 10.00000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -79.0782174419 TEST_000.OUT : -46.7988991488 absolute difference : 32.2793182931 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.790782174419E-03 Running test in directory test_011... ERROR STOP Error termination. Backtrace: #0 0x7fff81dd6873 in ??? #1 0x7fff81dd7f43 in ??? #2 0x7fff81dd99eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.80924075 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 2 loops Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.80736252 Required : 28.00000000 Info(elk): current task : 5 Info(genkmat): 1 of 2 k-points Info(genkmat): 2 of 2 k-points Info(hartfock): self-consistent loop number : 1 Info(eveqnhf): 2 of 2 k-points Info(eveqnhf): 1 of 2 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.23938643 Required : 28.00000000 Info(hartfock): self-consistent loop number : 2 Info(eveqnhf): 2 of 2 k-points Info(eveqnhf): 1 of 2 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 24.42823530 Required : 28.00000000 Info(exxengy): 1 of 2 k-points Info(exxengy): 2 of 2 k-points Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -579.532549312 TEST_000.OUT : -578.898961850 absolute difference : 0.633587462000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.579532549312E-02 Running test in directory test_012... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 12.52656735 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 12.52657318 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 12.52668036 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 12.52679907 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 12.52689609 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 12.52694644 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 12.52697130 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 12.52697590 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 12.52697954 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 12.52698347 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 12.52698453 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 12.52698447 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 12.52698439 Required : 13.00000000 Info(elk): current task : 200 Info(phononsc): working on DYN_Q0000_0000_0000_S01_A001_P1.OUT Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 113 The leading minor of the overlap matrix of order 55 is not positive definite Order of overlap matrix : 58 Running test in directory test_013... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.3828 Info(checkmt): reduced muffin-tin radius of species 2 (Al) from 2.2000 to 2.1842 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 129 The leading minor of the overlap matrix of order 53 is not positive definite Order of overlap matrix : 76 Running test in directory test_014... ERROR STOP Error termination. Backtrace: #0 0x7fff92336873 in ??? #1 0x7fff92337f43 in ??? #2 0x7fff923399eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 26.14171296 Required : 28.00000000 Info(oepvcl): 1 of 8 k-points Info(oepvcl): 5 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepmain): done 10 iterations of 100 Info(oepmain): done 20 iterations of 100 Info(oepmain): done 30 iterations of 100 Info(oepmain): done 40 iterations of 100 Info(oepmain): done 50 iterations of 100 Info(oepmain): done 60 iterations of 100 Info(oepmain): done 70 iterations of 100 Info(oepmain): done 80 iterations of 100 Info(oepmain): done 90 iterations of 100 Info(oepmain): done 100 iterations of 100 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 26.12742738 Required : 28.00000000 Info(oepvcl): 1 of 8 k-points Info(oepvcl): 5 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepmain): done 10 iterations of 100 Info(oepmain): done 20 iterations of 100 Info(oepmain): done 30 iterations of 100 Info(oepmain): done 40 iterations of 100 Info(oepmain): done 50 iterations of 100 Info(oepmain): done 60 iterations of 100 Info(oepmain): done 70 iterations of 100 Info(oepmain): done 80 iterations of 100 Info(oepmain): done 90 iterations of 100 Info(oepmain): done 100 iterations of 100 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 26.08191567 Required : 28.00000000 Info(oepvcl): 1 of 8 k-points Info(oepvcl): 5 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepmain): done 10 iterations of 100 Info(oepmain): done 20 iterations of 100 Info(oepmain): done 30 iterations of 100 Info(oepmain): done 40 iterations of 100 Info(oepmain): done 50 iterations of 100 Info(oepmain): done 60 iterations of 100 Info(oepmain): done 70 iterations of 100 Info(oepmain): done 80 iterations of 100 Info(oepmain): done 90 iterations of 100 Info(oepmain): done 100 iterations of 100 Warning(gndstate): failed to reach self-consistency after 4 loops Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 26.07565060 Required : 28.00000000 Info(oepvcl): 1 of 8 k-points Info(oepvcl): 5 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepmain): done 10 iterations of 100 Info(oepmain): done 20 iterations of 100 Info(oepmain): done 30 iterations of 100 Info(oepmain): done 40 iterations of 100 Info(oepmain): done 50 iterations of 100 Info(oepmain): done 60 iterations of 100 Info(oepmain): done 70 iterations of 100 Info(oepmain): done 80 iterations of 100 Info(oepmain): done 90 iterations of 100 Info(oepmain): done 100 iterations of 100 Info(exxengy): 5 of 8 k-points Info(exxengy): 1 of 8 k-points Info(exxengy): 2 of 8 k-points Info(exxengy): 6 of 8 k-points Info(exxengy): 3 of 8 k-points Info(exxengy): 7 of 8 k-points Info(exxengy): 4 of 8 k-points Info(exxengy): 8 of 8 k-points Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -530.380788873 TEST_000.OUT : -532.111748975 absolute difference : 1.73096010200 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.530380788873E-02 Running test in directory test_015... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff94266873 in ??? #1 0x7fff94267f43 in ??? #2 0x7fff942699eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.2267 Info(checkmt): reduced muffin-tin radius of species 2 (O) from 1.8000 to 1.6700 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -24.11500610 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 254.3518233 Required : 72.00000000 Info(findlambda): lambda obtained in 8 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 51.33599999 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 9 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 51.62620474 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 50.82915919 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 49.03649810 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 44.47285841 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 44.53063768 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 45.25750030 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 49.53360707 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 14 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 49.42014227 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 11 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -1521.662457 -4.590500000 for s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 39024.10230 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 3 linearisation energies in s.c. loop 12 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8685.586350 -4.590500000 for s.c. loop 12 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 12 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 12 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 12 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 16.80077314 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 3 linearisation energies in s.c. loop 13 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -468.6548840 -4.590500000 for s.c. loop 13 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 13 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 13 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 7.901685043 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 3 linearisation energies in s.c. loop 14 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6276.629049 -4.590500000 for s.c. loop 14 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 14 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 14 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 10.76547284 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 3 linearisation energies in s.c. loop 15 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -469.0328550 -4.590500000 for s.c. loop 15 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 15 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 15 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 10.64340934 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 3 linearisation energies in s.c. loop 16 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -144.3226842 -4.590500000 for s.c. loop 16 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 16 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 16 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 9.411820288 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 3 linearisation energies in s.c. loop 17 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -90.16390713 -4.590500000 for s.c. loop 17 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 17 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 17 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 9.640232801 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 3 linearisation energies in s.c. loop 18 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -51.86555273 -4.590500000 for s.c. loop 18 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 18 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 18 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 15.59322414 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 3 linearisation energies in s.c. loop 19 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -25.51178387 -4.590500000 for s.c. loop 19 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 19 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 19 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 14.77005237 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 3 linearisation energies in s.c. loop 20 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -10.35963458 -4.590500000 for s.c. loop 20 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 20 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 20 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 42.13191806 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 3 linearisation energies in s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 54.66558225 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 3 linearisation energies in s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 54.64374849 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 46.55279226 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 45.93336394 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 45.46190080 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 46.45850283 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 47.00119232 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 48.06458136 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 47.82257993 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 51.58185324 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 54.39633989 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 46.19986004 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 54.45869890 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 47.65596499 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 48.45363239 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 55.75690252 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 48.14651805 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 49.22489642 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 51.96932729 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 49.78125190 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 53.42334260 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 52.50938935 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 50.67358396 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 50.48188970 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 50.51013436 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 51.01773516 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 50.24880192 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 51.28090233 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 51.56918305 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 51.14306990 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 51.35613630 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 50.94761480 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 50.78347131 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 51.53261928 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 50.32067856 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 50.62372908 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 52.06894689 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 50.18266419 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 50.82400851 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 50.89466206 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 50.17212544 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 51.84800645 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 51.40411959 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 50.59041396 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 50.85999582 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 50.44635851 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 50.01707690 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 51.84793923 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 50.57275097 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 50.78662786 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 51.12690024 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 50.34176821 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 52.43032015 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 51.20321276 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 50.57907082 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 50.45829322 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 51.03649397 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 51.01084029 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 51.33292761 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 50.43470977 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 51.45122282 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 50.70756920 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 52.05209177 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 48.29408477 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 53.02229018 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 50.35787549 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 50.80445404 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 50.92728277 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 50.60533460 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 50.43899244 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 51.29766428 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 50.30474920 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 51.26044803 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 50.60701682 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 51.31749221 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 51.39488131 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 49.30724030 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 52.25538597 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 50.41429117 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 50.17829049 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 52.05919876 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 50.31492374 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 51.23342241 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 50.94345212 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 51.41021280 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 50.11277198 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 51.62400203 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 51.30888578 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 50.85545843 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 50.65412498 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 51.57215962 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 50.57693700 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 51.02108967 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 51.19102387 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 50.51486008 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 50.60442206 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 51.18538549 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 51.26737363 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 50.30419044 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 52.98852060 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 49.90690449 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 50.07705097 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 50.42596251 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 49.94407078 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 51.20885007 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 51.07346276 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 51.39791233 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 50.46964303 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 51.04065646 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 51.81076618 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 50.86262565 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 50.97521576 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 51.03741049 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 50.98466798 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 50.69518416 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 50.46889476 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 50.15984573 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 51.86847096 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 50.58125206 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 51.53882498 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 51.45891077 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 50.86963402 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 50.84148778 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 51.09597424 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 51.67270605 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 51.75978332 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 50.74969250 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 51.27173193 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 51.21238740 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 50.75428869 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 51.71143406 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 50.20772651 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 50.51432122 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 50.54369738 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 50.26796511 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 52.72786920 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 50.10393696 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 51.75506909 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 50.45217222 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 51.58907147 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 50.80372065 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 52.27984814 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 50.83237150 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 50.14771808 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 50.87117380 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 50.37403345 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 52.37173607 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 50.62803556 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 50.59950085 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 51.39512357 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 52.70588486 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 50.54747030 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 50.78045332 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 50.96216320 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 50.48486968 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 51.04334667 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 50.59336513 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 50.48448559 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 51.06685757 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 50.70405478 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 51.44341264 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 50.36266524 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 51.29096052 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 50.55988571 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 50.77797064 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 51.81977403 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 50.36913071 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 50.70683038 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 51.88880444 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 51.00218794 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 50.58616753 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 50.15767663 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 52.01609403 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 50.93492330 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 50.44126770 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 52.05790204 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 50.25572937 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 50.11500790 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 51.76760813 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 49.37669367 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Info(elk): current task : 400 Info(writetm): Tensor moment decomposition of density matrix in the spherical basis written to TENSMOM.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -3186.18768675 TEST_000.OUT : -3097.34008594 absolute difference : 88.8476008100 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.318618768675E-01 Running test in directory test_016... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff87ee6873 in ??? #1 0x7fff87ee7f43 in ??? #2 0x7fff87ee99eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (U) from 3.0000 to 2.9601 Info(checkmt): reduced muffin-tin radius of species 2 (S) from 2.2000 to 2.1708 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 96.68465848 Required : 108.0000000 Info(findlambda): lambda obtained in 8 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 96.56750490 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 96.42541832 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 96.18780467 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 96.45918422 Required : 108.0000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 94.56939598 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 95.78885654 Required : 108.0000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 95.71477379 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 95.39659965 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(gndstate): failed to reach self-consistency after 10 loops Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 95.32052084 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Info(elk): current task : 400 Info(writetm): Tensor moment decomposition of density matrix in the spherical basis written to TENSMOM.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -28328.4711959 TEST_000.OUT : -28506.5050740 absolute difference : 178.033878100 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.283284711959 Running test in directory test_017... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.4000 to 2.2888 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.4000 to 2.2888 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 223 The leading minor of the overlap matrix of order 98 is not positive definite Order of overlap matrix : 125 Running test in directory test_018... ERROR STOP Error termination. Backtrace: #0 0x7fff9f066873 in ??? #1 0x7fff9f067f43 in ??? #2 0x7fff9f0699eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 40.27411364 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 40.27582733 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 40.40714652 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 40.53251090 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 40.59937047 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 40.65578279 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 40.68438215 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 40.68797771 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 40.68842795 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 40.68884392 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 40.68864150 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 40.68858904 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 40.68858187 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 40.68858046 Required : 41.00000000 Info(elk): current task : 205 Info(phonon): working on DYN_Q0000_0000_0000_S01_A001_P1.OUT Info(phonon): working on DYN_Q0102_0000_0000_S01_A001_P1.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0102_0102_0102_S01_A001_P1.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0000_0000_0000_S01_A001_P2.OUT Info(phonon): working on DYN_Q0102_0000_0000_S01_A001_P2.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0102_0102_0102_S01_A001_P2.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0000_0000_0000_S01_A001_P3.OUT Info(phonon): working on DYN_Q0102_0000_0000_S01_A001_P3.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0102_0102_0102_S01_A001_P3.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(dyntask): nothing more to do Info(elk): current task : 210 Info(phdos): phonon density of states written to PHDOS.OUT thermodynamic properties written to THERMO.OUT Info(elk): current task : 500 Error(testcheck): variable 10 outside tolerance for quantity 'phonon DOS' TEST_210.OUT_ (correct value) : 0.448026778003E-03 TEST_210.OUT : 0.00000000000 absolute difference : 0.448026778003E-03 required relative tolerance : 0.100000000000E-01 required absolute tolerance : 0.448026778003E-05 Running test in directory test_019... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.3297 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.898542575 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 71.72901335 Required : 28.00000000 Info(findlambda): lambda obtained in 8 iterations Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -15.87959350 -4.590500000 for s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 22.30737623 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 19.66902801 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 19.46436653 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 19.42783438 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 19.82965271 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 19.30438675 Required : 28.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 17.45552912 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.724870097 -4.590500000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 17.40322342 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 20.55558733 Required : 28.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 15 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 20.73440214 Required : 28.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 12 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 19.25705977 Required : 28.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 20.51560039 Required : 28.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 20.84132969 Required : 28.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 20.10065142 Required : 28.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 20.50775690 Required : 28.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 20.58632119 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 20.57453681 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 20.07277652 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 20.23927754 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 20.13997065 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 20.24226239 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 20.47379436 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 20.47542618 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 20.49838621 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 20.30253750 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 20.30645257 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 20.14213029 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 20.18908849 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 20.63773076 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 20.52932965 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 20.35755604 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 20.46915332 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 20.41383602 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 20.42663415 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 20.64489420 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 20.44542541 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 20.33085953 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 20.03045129 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 20.04362506 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 20.58040301 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 20.43983957 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 20.73432021 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 20.51645670 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 20.74872896 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 20.94690031 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 20.51149711 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 20.41460298 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 20.62338563 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 20.65934190 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 20.54613125 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 20.90668350 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 20.64108682 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 20.50598590 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 20.69936721 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 20.48183916 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 20.51169656 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 20.61749218 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 20.38879297 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 20.69117814 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 20.26037286 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 20.62739225 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 20.87239170 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 20.72029766 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 20.67113119 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 20.48056349 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 20.45142158 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 20.48881964 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 20.48873398 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 20.45416578 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 20.82788238 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 20.04089521 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 20.34280212 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 20.56740289 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 20.53251192 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 20.62931344 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 20.54503914 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 20.39430110 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 20.56967363 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 20.73767105 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 20.66012810 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 20.39911940 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 20.18503676 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 20.46300538 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 20.00715570 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 20.59883145 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 20.48498209 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 20.25495881 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 20.09575556 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 20.30560271 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 20.60503886 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 20.56666073 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 20.42821870 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 20.24801900 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 20.63069447 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 20.51053391 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 20.81880107 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 20.75218075 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 20.76820564 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 20.74034063 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 20.56010795 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 20.29651862 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 20.01081526 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 20.52041654 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 20.65203313 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 20.33668248 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 20.02986601 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 20.60457734 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 20.23857243 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 20.96226087 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 20.55174198 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 20.80241463 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 20.70214968 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 20.18158770 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 20.44380886 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 20.00798627 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 20.38930847 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 20.41000795 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 20.38667277 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 20.16536040 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 20.32686530 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 20.45338683 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 20.56552632 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 20.51226156 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 20.31747783 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 20.54037275 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 20.82723089 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 20.10040530 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 19.94083854 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 19.99525587 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 20.11559289 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 20.22375997 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 20.21285522 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 20.51944543 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 19.80993193 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 20.25775124 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 20.54958184 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 20.27133441 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 20.51340443 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 20.17576000 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 20.18391301 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 19.90396808 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 19.86094331 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 20.29349678 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 20.23603018 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 20.18683209 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 20.32641081 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 20.18884217 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 20.84495924 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 20.43651322 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 20.25023459 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 20.34689384 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 20.49655735 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 20.38176927 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 20.48914455 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 20.16355621 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 20.52665700 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 20.66614578 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 20.38659562 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 20.47073958 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 20.41778751 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 20.37255224 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 20.30232165 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 20.46099453 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 20.52077835 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 20.36532765 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 20.34221177 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 20.53532650 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 20.45900812 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 20.82594306 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 19.97404210 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 20.79180948 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 20.45892930 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 20.74637542 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 20.40584934 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 20.56266352 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 20.42573646 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 20.75845163 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 20.69734501 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 20.58119335 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 20.90261908 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 20.58869077 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 20.48063765 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 20.32301630 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 20.49002957 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 20.46573353 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 20.89320371 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 20.26610418 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 20.71162192 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 20.48746912 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 20.23954322 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 20.79727009 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 20.67308389 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 20.16821720 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 20.84041134 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 20.49838903 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 20.36185898 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 20.29676520 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 20.11289207 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 20.86556382 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Info(elk): current task : 450 Info(genafieldt): Time-dependent A-field written to AFIELDT.OUT Laser pulse and ramp parameters written to TD_INFO.OUT 1 atomic unit of time is 24.18884327 attoseconds Total simulation time : 50.00000000 in attoseconds : 1209.442163 Info(elk): current task : 460 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 51 The leading minor of the overlap matrix of order 19 is not positive definite Order of overlap matrix : 32 Running test in directory test_020... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff7fcb6873 in ??? #1 0x7fff7fcb7f43 in ??? #2 0x7fff7fcb99eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Li) from 1.8000 to 1.7782 Info(checkmt): reduced muffin-tin radius of species 2 (F) from 2.0000 to 1.9758 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 23.84125720 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 35.78035563 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 34.01256200 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.44731695 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 22.38362356 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 20.17233540 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 18.21912205 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 17.83526291 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 18.28788202 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 15.51031690 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 14.37025774 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 14.27282431 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 13.88216257 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 13.21535873 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 13.27164244 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 12.93030810 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 10.21583840 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 192325.0715 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 19 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -95934.71975 -3.878400000 for s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 0.1117887020E-49 Required : 12.00000000 Warning(rdirac): maximum iterations exceeded Warning(linengy): could not find 3 linearisation energies in s.c. loop 20 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -1090194.359 -3.878400000 for s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 0.3544924167E-51 Required : 12.00000000 Warning(rdirac): maximum iterations exceeded Warning(linengy): could not find 3 linearisation energies in s.c. loop 21 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -165112.2209 -3.878400000 for s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 0.5020800788E-52 Required : 12.00000000 Warning(rdirac): maximum iterations exceeded Warning(linengy): could not find 3 linearisation energies in s.c. loop 22 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -14661.25936 -3.878400000 for s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 0.9742782955E-65 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 23 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -1759.084566 -3.878400000 for s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 0.1407782662E-04 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 24 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4748.448116 -3.878400000 for s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 1.400461361 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 25 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -396.3032448 -3.878400000 for s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 0.4321017996-126 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 26 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -306.7574169 -3.878400000 for s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 0.8769588723-149 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 27 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.119154068 -3.878400000 for s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 11.03441581 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 10.03419216 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 12.37573357 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 9.662641336 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 11.63650316 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 14.21096488 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 12.56814255 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 11.04985489 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 16.33081162 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 10.95333842 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 10.71056167 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 17.90250297 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 12.04220816 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 10.79290178 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 11.19222809 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 12.53273701 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 12.56836448 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 11.71310947 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 12.01899489 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 12.31576387 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 12.16837092 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 12.20154160 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 12.20043565 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 12.20311808 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 12.20288503 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 12.20263634 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 12.20245589 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 12.20240164 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 12.20239191 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 12.20239397 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 12.20239485 Required : 12.00000000 Info(elk): current task : 600 Info(genpmat): 5 of 8 k-points Info(genpmat): 1 of 8 k-points Info(genpmat): 2 of 8 k-points Info(genpmat): 6 of 8 k-points Info(genpmat): 3 of 8 k-points Info(genpmat): 7 of 8 k-points Info(genpmat): 8 of 8 k-points Info(genpmat): 4 of 8 k-points Info(epsinv): 1 of 3 q-points Info(epsinv): 2 of 3 q-points Info(epsinv): 3 of 3 q-points Info(gwsefm): 5 of 8 k-points Info(gwsefm): 1 of 8 k-points Info(gwsefm): 6 of 8 k-points Info(gwsefm): 2 of 8 k-points Info(gwsefm): 7 of 8 k-points Info(gwsefm): 3 of 8 k-points Info(gwsefm): 4 of 8 k-points Info(gwsefm): 8 of 8 k-points Info(gwsefm): GW self-energy at the fermionic frequencies written to GWSEFM.OUT Info(elk): current task : 610 Info(gwspecf): 5 of 8 k-points Info(gwspecf): 1 of 8 k-points Info(gwspecf): 6 of 8 k-points Info(gwspecf): 2 of 8 k-points Info(gwspecf): 7 of 8 k-points Info(gwspecf): 3 of 8 k-points Info(gwspecf): 8 of 8 k-points Info(gwspecf): 4 of 8 k-points Info(gw): GW spectral functions and Kohn-Sham eigenvalues written to GWSF_Kkkkkkk.OUT for all k-points Total GW spectral function written to GWTSF.OUT Fermi energy for the Kohn-Sham eigenvalues is at zero in plots Fermi energy for the GW spectral function is undetermined Spectral function units are states/Hartree/unit cell Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -106.905850836 TEST_000.OUT : -106.974688503 absolute difference : 0.688376670000E-01 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.106905850836E-02 Running test in directory test_021... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffaa456873 in ??? #1 0x7fffaa457f43 in ??? #2 0x7fffaa4599eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Mn) from 2.4000 to 2.3708 Info(checkmt): reduced muffin-tin radius of species 2 (O) from 1.8000 to 1.7781 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 45.45915193 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 45.63859370 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 46.40445445 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -21.63562893 -5.137200000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 91.05960189 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 50.78338012 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 44.36489819 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 148.9675383 Required : 66.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 44.82925290 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.009325256 -5.137200000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 44.25981498 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 44.72643074 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.771637678 -5.137200000 for s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 44.65809201 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 44.55631997 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 43.52873599 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 44.03280715 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 44.39597059 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 43.88862336 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 43.68196289 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 43.75425090 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 42.58047295 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 43.01871371 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 43.15938533 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 44.13765365 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 43.53671960 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 43.54353818 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 43.53374691 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 42.42256583 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 42.59874176 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 43.01985587 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 42.31018382 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 42.88089146 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 43.00170866 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 42.94054252 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 43.44049207 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 42.60246024 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 42.70888185 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 43.64313434 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 42.98623371 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 43.04198129 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 43.01217749 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 43.16963747 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.339116793 -5.137200000 for s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 43.25648396 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.455641316 -5.137200000 for s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 42.87362259 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 43.06361948 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 43.85457706 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 44.13015414 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 43.90399951 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 44.12957729 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 42.03294030 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 41.92870016 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 43.13900453 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.367754941 -5.137200000 for s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 42.70451409 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 42.91031509 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 42.83063908 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 43.37451081 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 44.09493406 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 42.42611342 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 44.51902089 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 43.76443376 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 43.66841841 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 43.36779989 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 43.55067951 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 43.25833884 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 43.33103948 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 43.99738897 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 43.58028175 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 43.18210448 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 42.69486749 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 43.12386372 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 43.47551848 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 43.43899673 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 43.68957757 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 43.49411694 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 43.24350086 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 43.48507521 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 43.62602279 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 43.40316329 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 43.46144979 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 43.47295493 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 42.74722628 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 43.47764245 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 43.56659177 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 43.60304315 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 43.48403483 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 43.56873152 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 44.07797614 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 44.04301960 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 43.80584680 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 42.74010175 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 42.86263433 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 43.55570963 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 43.18295470 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 43.11991226 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 42.75873127 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 42.97699564 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 43.16258584 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 42.97087369 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 42.62829898 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 43.89364417 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 42.97240094 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 44.30998166 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 43.83508152 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 43.44551499 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 42.80431572 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 42.99448938 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 42.04030269 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 43.15573061 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 43.46316366 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 43.76664329 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 43.50461879 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 43.53433723 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 43.36145670 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 43.52037458 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 43.81123143 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 43.64619850 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 43.60539063 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 43.66863212 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 44.02002215 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 43.60780621 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 43.47088681 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 43.57302398 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 43.51186694 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 43.08159773 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 44.25086397 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 44.11662468 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 43.42036382 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 43.52409405 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 43.99248589 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 43.49904660 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 44.01016096 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 43.83951048 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 43.84371834 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 43.63973909 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 43.74678306 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 43.70579436 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 42.97080938 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 43.16053161 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 42.88120912 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 43.76044135 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 42.84610596 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 43.10414586 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 43.09876230 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 43.14591025 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 43.80379517 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 42.99205449 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 43.27613362 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 43.67674162 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 43.39220879 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 43.14307299 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 43.71496354 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 43.09018180 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 43.59411433 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 43.85994277 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 43.72011719 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 43.72792121 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 44.15434542 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 43.57349278 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 43.73595787 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 44.19032658 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 43.53625223 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 43.71185957 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 43.43107244 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 43.60424018 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 44.33556267 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 43.54251021 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 43.49822907 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 43.45825165 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.150763436 -5.137200000 for s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 43.04117376 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 43.77916650 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 43.55656948 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 43.65049661 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 43.55607251 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 44.19534750 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 43.72861959 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 43.66909920 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 43.63503212 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 43.25997518 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 43.01776778 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 42.52252667 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 44.02398953 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 44.06037598 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 43.68478529 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 43.65848791 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 43.25646633 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 43.69304951 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 43.70360565 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 44.11591804 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 44.01100928 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 43.37244617 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 44.13509022 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 44.11216244 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 43.68319459 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 43.70366526 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 43.51713959 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 43.28941139 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 43.82433433 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 43.65269532 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 43.88211262 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 44.06254045 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 43.78779840 Required : 66.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 43.76272249 Required : 66.00000000 Info(elk): current task : 195 Info(sfacrho): density structure factors written to SFACRHO.OUT Energy window : -1000000.000 1000000.000 Info(elk): current task : 196 Info(sfacmag): magnetic structure factors written to SFACMAG_j.OUT for magnetic components j = 1 (this corresponds to the z-component of the magnetisation) Energy window : -1000000.000 1000000.000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -2462.70061065 TEST_000.OUT : -2497.31353760 absolute difference : 34.6129269500 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.246270061065E-01 Running test in directory test_022... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffb6296873 in ??? #1 0x7fffb6297f43 in ??? #2 0x7fffb62999eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.3297 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.036711134 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 27.38528980 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.307033771 -4.590500000 for s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 26.00189885 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -10.94404570 -4.590500000 for s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 24.54247332 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -11.70106452 -4.590500000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 24.06061802 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -9.996923937 -4.590500000 for s.c. loop 5 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 26.82900683 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 23.87011484 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 19.67295175 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 19.57859167 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 19.59341311 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 19.60344606 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 19.38477979 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 19.67800553 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 19.18217647 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.995625065 -4.590500000 for s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 18.60392909 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.240434306 -4.590500000 for s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 17.31477938 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 17.89687694 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 18.51791672 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 19.48634085 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 18.49905651 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 19.71690621 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 19.48809472 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 19.43684287 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 20.37895385 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 20.53648824 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 20.74344604 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 19.88204413 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 17.85724055 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.754146659 -4.590500000 for s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 17.69461260 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.258326607 -4.590500000 for s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 17.39354271 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 17.60270513 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 17.63765951 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 18.98252205 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 18.15616738 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 18.69098823 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.901521502 -4.590500000 for s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 18.59576643 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.836107080 -4.590500000 for s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 18.28232278 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.989289217 -4.590500000 for s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 19.01708287 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 18.76780060 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.166755203 -4.590500000 for s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 18.95968232 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 18.14377651 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 18.14727788 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 18.32920309 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.665515285 -4.590500000 for s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 19.01315798 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 18.95674455 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 17.50957148 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 18.50599442 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 18.37984363 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.815571557 -4.590500000 for s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 17.61554342 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 18.29790384 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 17.75695548 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 17.17992711 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 20.79605521 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 20.02753919 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 21.10585604 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 21.22769489 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 21.04892371 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 21.09892771 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 20.89118958 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 20.82252553 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 20.67314105 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 20.73970257 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 20.42601934 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 20.58775285 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 20.41451783 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 20.48058999 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 20.39351700 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 20.44012463 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 20.47382060 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 20.38078376 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 20.31426610 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 20.33616008 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 20.46279648 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 20.27763798 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 20.50706537 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 20.36078940 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 20.32136001 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 20.32988343 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 20.32862537 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 20.02381498 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 20.53432965 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 20.47596348 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 20.38476710 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 20.48274712 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 20.49143797 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 20.45624622 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 19.69771230 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 20.51598081 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 20.50167346 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 20.24625618 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 20.52107337 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 20.37859883 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 20.34360147 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 20.37110415 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 19.86818688 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 20.55034130 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 20.13674332 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 20.60648882 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 20.63956260 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 20.64235975 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 20.02353894 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 20.64687608 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 20.44156578 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 20.42593413 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 20.33869545 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 20.44506948 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 20.40166691 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 20.59546703 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 20.40272806 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 20.58730067 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 20.45458624 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 19.61561586 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 20.57719444 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 20.52733839 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 20.47814780 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 20.48062846 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 20.53810880 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 20.52590598 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 20.23042445 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 20.02593827 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 20.08789078 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 20.28647106 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 20.04227141 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 20.02747866 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 20.02066930 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 20.05792728 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 20.19156126 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 20.28738666 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 20.55979833 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 20.35927750 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 20.37249781 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 20.51388049 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 20.36527691 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 20.43951109 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 20.61790205 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 20.35687677 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 20.48614258 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 20.39458415 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 20.33942794 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 20.57965650 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 20.23307050 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 20.40717551 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 20.60000679 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 20.38353738 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 20.62946449 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 20.69369178 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 20.47154418 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 20.56866803 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 20.37628629 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 20.27886819 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 20.56224903 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 20.67562950 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 20.50632198 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 20.36474270 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 20.46800430 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 20.56291488 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 20.55553244 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 20.46493553 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 20.51954998 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 20.34545974 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 20.34092822 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 20.42623784 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 20.37427912 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 20.58634069 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 20.62467358 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 20.44646047 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 20.51313199 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 20.54602527 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 20.52194386 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 20.37133406 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 20.51251698 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 20.21904722 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 20.16648258 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 20.16100835 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 20.64914446 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 20.02295721 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 20.04876064 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 19.93807378 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 19.95798416 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 19.95497250 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 18.91866272 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 19.65947646 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 19.33820279 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 19.17268645 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 19.02976571 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 19.14358777 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 19.23415788 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 19.08638817 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 19.31301374 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 19.85722153 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 20.06723799 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 20.08231413 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 19.47365974 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 19.63126830 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 19.84105004 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 20.04333762 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 20.30733512 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 20.42799573 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 20.21533646 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 20.35755721 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 20.07713969 Required : 28.00000000 Info(elk): current task : 330 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Info(tddftsplr): 501 of 1000 k-points Info(tddftsplr): 1 of 1000 k-points Info(tddftsplr): 2 of 1000 k-points Info(tddftsplr): 502 of 1000 k-points Info(tddftsplr): 3 of 1000 k-points Info(tddftsplr): 503 of 1000 k-points Info(tddftsplr): 4 of 1000 k-points Info(tddftsplr): 504 of 1000 k-points Info(tddftsplr): 5 of 1000 k-points Info(tddftsplr): 505 of 1000 k-points Info(tddftsplr): 6 of 1000 k-points Info(tddftsplr): 506 of 1000 k-points Info(tddftsplr): 7 of 1000 k-points Info(tddftsplr): 507 of 1000 k-points Info(tddftsplr): 8 of 1000 k-points Info(tddftsplr): 508 of 1000 k-points Info(tddftsplr): 9 of 1000 k-points Info(tddftsplr): 509 of 1000 k-points Info(tddftsplr): 10 of 1000 k-points Info(tddftsplr): 510 of 1000 k-points Info(tddftsplr): 11 of 1000 k-points Info(tddftsplr): 511 of 1000 k-points Info(tddftsplr): 12 of 1000 k-points Info(tddftsplr): 512 of 1000 k-points Info(tddftsplr): 13 of 1000 k-points Info(tddftsplr): 513 of 1000 k-points Info(tddftsplr): 14 of 1000 k-points Info(tddftsplr): 514 of 1000 k-points Info(tddftsplr): 15 of 1000 k-points Info(tddftsplr): 515 of 1000 k-points Info(tddftsplr): 16 of 1000 k-points Info(tddftsplr): 516 of 1000 k-points Info(tddftsplr): 17 of 1000 k-points Info(tddftsplr): 517 of 1000 k-points Info(tddftsplr): 18 of 1000 k-points Info(tddftsplr): 518 of 1000 k-points Info(tddftsplr): 19 of 1000 k-points Info(tddftsplr): 519 of 1000 k-points Info(tddftsplr): 20 of 1000 k-points Info(tddftsplr): 520 of 1000 k-points Info(tddftsplr): 21 of 1000 k-points Info(tddftsplr): 521 of 1000 k-points Info(tddftsplr): 22 of 1000 k-points Info(tddftsplr): 522 of 1000 k-points Info(tddftsplr): 23 of 1000 k-points Info(tddftsplr): 523 of 1000 k-points Info(tddftsplr): 24 of 1000 k-points Info(tddftsplr): 524 of 1000 k-points Info(tddftsplr): 25 of 1000 k-points Info(tddftsplr): 525 of 1000 k-points Info(tddftsplr): 26 of 1000 k-points Info(tddftsplr): 526 of 1000 k-points Info(tddftsplr): 27 of 1000 k-points Info(tddftsplr): 527 of 1000 k-points Info(tddftsplr): 28 of 1000 k-points Info(tddftsplr): 528 of 1000 k-points Info(tddftsplr): 29 of 1000 k-points Info(tddftsplr): 30 of 1000 k-points Info(tddftsplr): 529 of 1000 k-points Info(tddftsplr): 31 of 1000 k-points Info(tddftsplr): 530 of 1000 k-points Info(tddftsplr): 32 of 1000 k-points Info(tddftsplr): 531 of 1000 k-points Info(tddftsplr): 33 of 1000 k-points Info(tddftsplr): 532 of 1000 k-points Info(tddftsplr): 34 of 1000 k-points Info(tddftsplr): 533 of 1000 k-points Info(tddftsplr): 35 of 1000 k-points Info(tddftsplr): 534 of 1000 k-points Info(tddftsplr): 535 of 1000 k-points Info(tddftsplr): 36 of 1000 k-points Info(tddftsplr): 37 of 1000 k-points Info(tddftsplr): 536 of 1000 k-points Info(tddftsplr): 38 of 1000 k-points Info(tddftsplr): 537 of 1000 k-points Info(tddftsplr): 39 of 1000 k-points Info(tddftsplr): 538 of 1000 k-points Info(tddftsplr): 40 of 1000 k-points Info(tddftsplr): 539 of 1000 k-points Info(tddftsplr): 41 of 1000 k-points Info(tddftsplr): 540 of 1000 k-points Info(tddftsplr): 42 of 1000 k-points Info(tddftsplr): 541 of 1000 k-points Info(tddftsplr): 43 of 1000 k-points Info(tddftsplr): 542 of 1000 k-points Info(tddftsplr): 44 of 1000 k-points Info(tddftsplr): 543 of 1000 k-points Info(tddftsplr): 45 of 1000 k-points Info(tddftsplr): 544 of 1000 k-points Info(tddftsplr): 46 of 1000 k-points Info(tddftsplr): 545 of 1000 k-points Info(tddftsplr): 47 of 1000 k-points 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Info(tddftsplr): 977 of 1000 k-points Info(tddftsplr): 477 of 1000 k-points Info(tddftsplr): 978 of 1000 k-points Info(tddftsplr): 478 of 1000 k-points Info(tddftsplr): 979 of 1000 k-points Info(tddftsplr): 479 of 1000 k-points Info(tddftsplr): 980 of 1000 k-points Info(tddftsplr): 480 of 1000 k-points Info(tddftsplr): 981 of 1000 k-points Info(tddftsplr): 481 of 1000 k-points Info(tddftsplr): 982 of 1000 k-points Info(tddftsplr): 482 of 1000 k-points Info(tddftsplr): 983 of 1000 k-points Info(tddftsplr): 483 of 1000 k-points Info(tddftsplr): 984 of 1000 k-points Info(tddftsplr): 484 of 1000 k-points Info(tddftsplr): 985 of 1000 k-points Info(tddftsplr): 485 of 1000 k-points Info(tddftsplr): 986 of 1000 k-points Info(tddftsplr): 486 of 1000 k-points Info(tddftsplr): 987 of 1000 k-points Info(tddftsplr): 487 of 1000 k-points Info(tddftsplr): 988 of 1000 k-points Info(tddftsplr): 488 of 1000 k-points Info(tddftsplr): 989 of 1000 k-points Info(tddftsplr): 489 of 1000 k-points Info(tddftsplr): 990 of 1000 k-points Info(tddftsplr): 490 of 1000 k-points Info(tddftsplr): 991 of 1000 k-points Info(tddftsplr): 491 of 1000 k-points Info(tddftsplr): 992 of 1000 k-points Info(tddftsplr): 492 of 1000 k-points Info(tddftsplr): 993 of 1000 k-points Info(tddftsplr): 493 of 1000 k-points Info(tddftsplr): 994 of 1000 k-points Info(tddftsplr): 494 of 1000 k-points Info(tddftsplr): 995 of 1000 k-points Info(tddftsplr): 495 of 1000 k-points Info(tddftsplr): 996 of 1000 k-points Info(tddftsplr): 496 of 1000 k-points Info(tddftsplr): 997 of 1000 k-points Info(tddftsplr): 497 of 1000 k-points Info(tddftsplr): 998 of 1000 k-points Info(tddftsplr): 498 of 1000 k-points Info(tddftsplr): 999 of 1000 k-points Info(tddftsplr): 499 of 1000 k-points Info(tddftsplr): 1000 of 1000 k-points Info(tddftsplr): 500 of 1000 k-points Info(tddftsplr): Spin-dependent response function chi_ij(G,G',q,w) written to CHI_ij.OUT for i,j = 0-3; G = G' = 0; and all wplot frequencies q-vector (lattice coordinates) : 0.1000000000 0.3000000000 0.000000000 q-vector length : 0.4621801190 The elements of chi labeled by (i,j) form the 4x4 matrix : (_|_ _ _) chi(G,G',q,w) = ( | ) ( | ) ( | ) (0,0) is the charge-charge response drho/dv (0,1-3) is the charge-magnetisation response drho/dB (1-3,0) is the magnetisation-charge response dm/v (1-3,1-3) is the magnetisation-magnetisation response dm/dB Non-interacting Kohn-Sham reponse function written to CHI0_ij.OUT Transverse components corresponding to m_+- = m_x +- im_y written to CHI_T.OUT and CHI0_T.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1518.39249411 TEST_000.OUT : -1466.89961053 absolute difference : 51.4928835800 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.151839249411E-01 Running test in directory test_023... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff8ed96873 in ??? #1 0x7fff8ed97f43 in ??? #2 0x7fff8ed999eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Li) from 1.8000 to 1.7782 Info(checkmt): reduced muffin-tin radius of species 2 (F) from 2.0000 to 1.9758 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 7.552032258 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 7.387190799 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 7.402568206 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 7.858310272 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 7.300798331 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 6 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 6.137546525 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 7 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 5.604308512 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 7.830677260 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 5.623489057 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 6.422987360 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 6.465968579 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 7.019301870 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 6.857529245 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 5.903585086 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 6.305966923 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 6.202106943 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 6.304706269 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 6.190159184 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 6.273859579 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 6.141530369 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 6.278839975 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 6.152831368 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 6.118699481 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 6.228489379 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 6.222730072 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 6.204910508 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 6.043069692 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 6.168760747 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 6.045364932 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 6.049764142 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 6.095649690 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 6.066195697 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 6.319850628 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 6.166785341 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 5.994715828 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 6.003538792 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 6.061390867 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 6.332374018 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 6.175878297 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 6.287212824 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 6.371950222 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 6.180659419 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 6.232525689 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 6.057517243 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 6.173720609 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 6.086091277 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 6.234507360 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 6.132287550 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 6.179195122 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 6.293645649 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 6.279800860 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 6.095568258 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 6.049943010 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 6.055033569 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 6.367548648 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 6.088679375 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 6.202453821 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 6.307257424 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 6.154893909 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 6.186657019 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 5.895458979 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 6.265203826 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 6.234661448 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 6.237736724 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 6.157600616 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 6.252985856 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 6.001755398 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 6.077279298 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 6.187821505 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 6.145325585 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 6.168343879 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 6.092955327 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 6.138168176 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 6.096422480 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 6.030545813 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 5.982565729 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 5.947818984 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 6.044552632 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 6.092576067 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 6.068013147 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 5.919812135 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 5.849848148 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 6.000207451 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 5.947164303 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 5.986683781 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 5.936779703 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 6.146512502 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 6.035705483 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 6.233159983 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 6.447242303 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 6.444995389 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 6.272768104 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 6.199055143 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 6.094833405 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 5.880983580 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 6.389254230 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 6.167813086 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 6.026891848 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 6.103945596 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 6.059431475 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 6.047532936 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 6.042421247 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 6.125019367 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 6.093724681 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 6.242797760 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 6.417889962 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 6.171320688 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 6.235292273 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 6.122334984 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 5.921294943 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 6.237899320 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 6.140229910 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 6.103694626 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 6.069602769 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 6.139051678 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 5.990037696 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 6.064597475 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 6.039268876 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 6.086400227 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 6.293123555 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 6.201850738 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 6.189756830 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 6.247065749 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 6.317547417 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 6.300014250 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 6.417491963 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 6.266989780 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 6.383086788 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 6.451949244 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 6.368712533 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 6.188953019 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 6.232327106 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 5.974711708 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 6.160992425 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 6.013539787 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 6.167037547 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 6.102815524 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 6.029447096 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 6.050663047 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 6.058682481 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 6.099539558 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 6.146510610 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 5.975949609 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 6.077219315 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 6.058075151 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 6.072945705 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 6.238464305 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 6.064846099 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 6.112133590 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 6.337892140 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 6.158898650 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 5.976354803 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 6.348848361 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 6.234860037 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 6.279560870 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 6.146817428 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 6.009496527 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 6.374120518 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 6.140394051 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 6.025459030 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 6.116283249 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 6.155538334 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 6.045569400 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 6.041724531 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 6.198956853 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 6.132166530 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 6.080775049 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 6.011744444 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 6.125393882 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 6.017483436 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 6.005121595 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 6.138945399 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 5.923152684 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 6.298377125 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 6.059202662 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 6.332318187 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 6.275320899 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 6.044883656 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 6.016792429 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 6.101064184 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 6.079927894 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 6.060597221 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 6.169544045 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 6.089653352 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 6.245845672 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 6.222322177 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 6.084067983 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 6.255182365 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 6.209168871 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 6.134671823 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 6.154263839 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 6.072066909 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 6.239597662 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 6.112454326 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 6.100188892 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 6.234882878 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 6.192340655 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 6.018151125 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 6.054857309 Required : 12.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 6.084511751 Required : 12.00000000 Info(elk): current task : 120 Info(genpmat): 16 of 29 k-points Info(genpmat): 1 of 29 k-points Info(genpmat): 2 of 29 k-points Info(genpmat): 17 of 29 k-points Info(genpmat): 18 of 29 k-points Info(genpmat): 3 of 29 k-points Info(genpmat): 19 of 29 k-points Info(genpmat): 4 of 29 k-points Info(genpmat): 20 of 29 k-points Info(genpmat): 5 of 29 k-points Info(genpmat): 6 of 29 k-points Info(genpmat): 21 of 29 k-points Info(genpmat): 22 of 29 k-points Info(genpmat): 7 of 29 k-points Info(genpmat): 8 of 29 k-points Info(genpmat): 23 of 29 k-points Info(genpmat): 9 of 29 k-points Info(genpmat): 24 of 29 k-points Info(genpmat): 10 of 29 k-points Info(genpmat): 25 of 29 k-points Info(genpmat): 26 of 29 k-points Info(genpmat): 11 of 29 k-points Info(genpmat): 12 of 29 k-points Info(genpmat): 27 of 29 k-points Info(genpmat): 13 of 29 k-points Info(genpmat): 28 of 29 k-points Info(genpmat): 29 of 29 k-points Info(genpmat): 14 of 29 k-points Info(genpmat): 15 of 29 k-points Info(writepmat): momentum matrix elements written to file PMAT.OUT Info(elk): current task : 121 Info(dielectric): dielectric tensor written to EPSILON_ij.OUT optical conductivity written to SIGMA_ij.OUT for components i = 1, j = 1 Info(elk): current task : 125 Info(nonlinopt): 257 of 512 k-points Info(nonlinopt): 1 of 512 k-points Info(nonlinopt): 258 of 512 k-points Info(nonlinopt): 2 of 512 k-points Info(nonlinopt): 259 of 512 k-points Info(nonlinopt): 3 of 512 k-points Info(nonlinopt): 260 of 512 k-points Info(nonlinopt): 4 of 512 k-points Info(nonlinopt): 261 of 512 k-points Info(nonlinopt): 5 of 512 k-points Info(nonlinopt): 262 of 512 k-points Info(nonlinopt): 6 of 512 k-points Info(nonlinopt): 263 of 512 k-points Info(nonlinopt): 7 of 512 k-points Info(nonlinopt): 264 of 512 k-points Info(nonlinopt): 8 of 512 k-points Info(nonlinopt): 265 of 512 k-points Info(nonlinopt): 9 of 512 k-points Info(nonlinopt): 266 of 512 k-points Info(nonlinopt): 10 of 512 k-points Info(nonlinopt): 267 of 512 k-points Info(nonlinopt): 11 of 512 k-points Info(nonlinopt): 268 of 512 k-points Info(nonlinopt): 12 of 512 k-points Info(nonlinopt): 269 of 512 k-points Info(nonlinopt): 13 of 512 k-points Info(nonlinopt): 270 of 512 k-points Info(nonlinopt): 14 of 512 k-points Info(nonlinopt): 271 of 512 k-points Info(nonlinopt): 15 of 512 k-points Info(nonlinopt): 272 of 512 k-points Info(nonlinopt): 16 of 512 k-points Info(nonlinopt): 273 of 512 k-points Info(nonlinopt): 17 of 512 k-points Info(nonlinopt): 274 of 512 k-points Info(nonlinopt): 18 of 512 k-points Info(nonlinopt): 275 of 512 k-points Info(nonlinopt): 19 of 512 k-points Info(nonlinopt): 276 of 512 k-points Info(nonlinopt): 20 of 512 k-points Info(nonlinopt): 277 of 512 k-points Info(nonlinopt): 21 of 512 k-points Info(nonlinopt): 278 of 512 k-points Info(nonlinopt): 22 of 512 k-points Info(nonlinopt): 279 of 512 k-points Info(nonlinopt): 23 of 512 k-points Info(nonlinopt): 280 of 512 k-points Info(nonlinopt): 24 of 512 k-points Info(nonlinopt): 281 of 512 k-points Info(nonlinopt): 25 of 512 k-points Info(nonlinopt): 282 of 512 k-points Info(nonlinopt): 26 of 512 k-points Info(nonlinopt): 283 of 512 k-points Info(nonlinopt): 27 of 512 k-points Info(nonlinopt): 284 of 512 k-points Info(nonlinopt): 28 of 512 k-points Info(nonlinopt): 285 of 512 k-points Info(nonlinopt): 29 of 512 k-points Info(nonlinopt): 286 of 512 k-points Info(nonlinopt): 30 of 512 k-points Info(nonlinopt): 287 of 512 k-points Info(nonlinopt): 31 of 512 k-points Info(nonlinopt): 288 of 512 k-points Info(nonlinopt): 32 of 512 k-points Info(nonlinopt): 289 of 512 k-points Info(nonlinopt): 33 of 512 k-points Info(nonlinopt): 290 of 512 k-points Info(nonlinopt): 34 of 512 k-points Info(nonlinopt): 291 of 512 k-points Info(nonlinopt): 35 of 512 k-points Info(nonlinopt): 292 of 512 k-points Info(nonlinopt): 36 of 512 k-points Info(nonlinopt): 293 of 512 k-points Info(nonlinopt): 37 of 512 k-points Info(nonlinopt): 294 of 512 k-points Info(nonlinopt): 38 of 512 k-points Info(nonlinopt): 295 of 512 k-points Info(nonlinopt): 39 of 512 k-points Info(nonlinopt): 296 of 512 k-points Info(nonlinopt): 297 of 512 k-points Info(nonlinopt): 40 of 512 k-points Info(nonlinopt): 298 of 512 k-points Info(nonlinopt): 41 of 512 k-points Info(nonlinopt): 299 of 512 k-points Info(nonlinopt): 42 of 512 k-points Info(nonlinopt): 300 of 512 k-points Info(nonlinopt): 43 of 512 k-points Info(nonlinopt): 301 of 512 k-points Info(nonlinopt): 44 of 512 k-points Info(nonlinopt): 302 of 512 k-points Info(nonlinopt): 45 of 512 k-points Info(nonlinopt): 303 of 512 k-points Info(nonlinopt): 46 of 512 k-points Info(nonlinopt): 304 of 512 k-points Info(nonlinopt): 47 of 512 k-points Info(nonlinopt): 305 of 512 k-points Info(nonlinopt): 48 of 512 k-points Info(nonlinopt): 306 of 512 k-points Info(nonlinopt): 49 of 512 k-points Info(nonlinopt): 307 of 512 k-points Info(nonlinopt): 50 of 512 k-points Info(nonlinopt): 308 of 512 k-points Info(nonlinopt): 51 of 512 k-points Info(nonlinopt): 309 of 512 k-points Info(nonlinopt): 52 of 512 k-points Info(nonlinopt): 310 of 512 k-points Info(nonlinopt): 53 of 512 k-points 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Info(nonlinopt): susceptibility tensor written to CHI_abc.OUT interband contributions written to CHI_INTERx_abc.OUT intraband contributions written to CHI_INTRAx_abc.OUT for components a = 1, b = 1, c = 1 Info(elk): current task : 320 Info(tddftlr): 257 of 512 k-points Info(tddftlr): 1 of 512 k-points Info(tddftlr): 258 of 512 k-points Info(tddftlr): 2 of 512 k-points Info(tddftlr): 259 of 512 k-points Info(tddftlr): 3 of 512 k-points Info(tddftlr): 4 of 512 k-points Info(tddftlr): 260 of 512 k-points Info(tddftlr): 5 of 512 k-points Info(tddftlr): 261 of 512 k-points Info(tddftlr): 6 of 512 k-points Info(tddftlr): 262 of 512 k-points Info(tddftlr): 263 of 512 k-points Info(tddftlr): 7 of 512 k-points Info(tddftlr): 264 of 512 k-points Info(tddftlr): 8 of 512 k-points Info(tddftlr): 265 of 512 k-points Info(tddftlr): 9 of 512 k-points Info(tddftlr): 266 of 512 k-points Info(tddftlr): 10 of 512 k-points Info(tddftlr): 267 of 512 k-points Info(tddftlr): 11 of 512 k-points Info(tddftlr): 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of 512 k-points Info(tddftlr): 125 of 512 k-points Info(tddftlr): 387 of 512 k-points Info(tddftlr): 126 of 512 k-points Info(tddftlr): 388 of 512 k-points Info(tddftlr): 127 of 512 k-points Info(tddftlr): 389 of 512 k-points Info(tddftlr): 128 of 512 k-points Info(tddftlr): 390 of 512 k-points Info(tddftlr): 129 of 512 k-points Info(tddftlr): 391 of 512 k-points Info(tddftlr): 130 of 512 k-points Info(tddftlr): 392 of 512 k-points Info(tddftlr): 131 of 512 k-points Info(tddftlr): 393 of 512 k-points Info(tddftlr): 132 of 512 k-points Info(tddftlr): 394 of 512 k-points Info(tddftlr): 133 of 512 k-points Info(tddftlr): 395 of 512 k-points Info(tddftlr): 134 of 512 k-points Info(tddftlr): 396 of 512 k-points Info(tddftlr): 135 of 512 k-points Info(tddftlr): 397 of 512 k-points Info(tddftlr): 136 of 512 k-points Info(tddftlr): 398 of 512 k-points Info(tddftlr): 137 of 512 k-points Info(tddftlr): 138 of 512 k-points Info(tddftlr): 399 of 512 k-points Info(tddftlr): 139 of 512 k-points Info(tddftlr): 400 of 512 k-points Info(tddftlr): 140 of 512 k-points Info(tddftlr): 401 of 512 k-points Info(tddftlr): 141 of 512 k-points Info(tddftlr): 402 of 512 k-points Info(tddftlr): 142 of 512 k-points Info(tddftlr): 403 of 512 k-points Info(tddftlr): 143 of 512 k-points Info(tddftlr): 404 of 512 k-points Info(tddftlr): 144 of 512 k-points Info(tddftlr): 405 of 512 k-points Info(tddftlr): 145 of 512 k-points Info(tddftlr): 406 of 512 k-points Info(tddftlr): 146 of 512 k-points Info(tddftlr): 407 of 512 k-points Info(tddftlr): 147 of 512 k-points Info(tddftlr): 408 of 512 k-points Info(tddftlr): 148 of 512 k-points Info(tddftlr): 409 of 512 k-points Info(tddftlr): 149 of 512 k-points Info(tddftlr): 410 of 512 k-points Info(tddftlr): 150 of 512 k-points Info(tddftlr): 411 of 512 k-points Info(tddftlr): 151 of 512 k-points Info(tddftlr): 412 of 512 k-points Info(tddftlr): 152 of 512 k-points Info(tddftlr): 413 of 512 k-points Info(tddftlr): 153 of 512 k-points Info(tddftlr): 414 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of 512 k-points Info(tddftlr): 183 of 512 k-points Info(tddftlr): 443 of 512 k-points Info(tddftlr): 184 of 512 k-points Info(tddftlr): 444 of 512 k-points Info(tddftlr): 185 of 512 k-points Info(tddftlr): 445 of 512 k-points Info(tddftlr): 186 of 512 k-points Info(tddftlr): 446 of 512 k-points Info(tddftlr): 187 of 512 k-points Info(tddftlr): 447 of 512 k-points Info(tddftlr): 188 of 512 k-points Info(tddftlr): 448 of 512 k-points Info(tddftlr): 189 of 512 k-points Info(tddftlr): 449 of 512 k-points Info(tddftlr): 190 of 512 k-points Info(tddftlr): 450 of 512 k-points Info(tddftlr): 191 of 512 k-points Info(tddftlr): 451 of 512 k-points Info(tddftlr): 192 of 512 k-points Info(tddftlr): 452 of 512 k-points Info(tddftlr): 193 of 512 k-points Info(tddftlr): 453 of 512 k-points Info(tddftlr): 194 of 512 k-points Info(tddftlr): 195 of 512 k-points Info(tddftlr): 454 of 512 k-points Info(tddftlr): 196 of 512 k-points Info(tddftlr): 455 of 512 k-points Info(tddftlr): 197 of 512 k-points 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of 512 k-points Info(tddftlr): 213 of 512 k-points Info(tddftlr): 470 of 512 k-points Info(tddftlr): 214 of 512 k-points Info(tddftlr): 471 of 512 k-points Info(tddftlr): 215 of 512 k-points Info(tddftlr): 472 of 512 k-points Info(tddftlr): 216 of 512 k-points Info(tddftlr): 473 of 512 k-points Info(tddftlr): 217 of 512 k-points Info(tddftlr): 474 of 512 k-points Info(tddftlr): 218 of 512 k-points Info(tddftlr): 475 of 512 k-points Info(tddftlr): 219 of 512 k-points Info(tddftlr): 476 of 512 k-points Info(tddftlr): 220 of 512 k-points Info(tddftlr): 477 of 512 k-points Info(tddftlr): 221 of 512 k-points Info(tddftlr): 478 of 512 k-points Info(tddftlr): 222 of 512 k-points Info(tddftlr): 479 of 512 k-points Info(tddftlr): 223 of 512 k-points Info(tddftlr): 480 of 512 k-points Info(tddftlr): 224 of 512 k-points Info(tddftlr): 481 of 512 k-points Info(tddftlr): 225 of 512 k-points Info(tddftlr): 482 of 512 k-points Info(tddftlr): 226 of 512 k-points Info(tddftlr): 483 of 512 k-points Info(tddftlr): 227 of 512 k-points Info(tddftlr): 484 of 512 k-points Info(tddftlr): 228 of 512 k-points Info(tddftlr): 485 of 512 k-points Info(tddftlr): 229 of 512 k-points Info(tddftlr): 486 of 512 k-points Info(tddftlr): 230 of 512 k-points Info(tddftlr): 487 of 512 k-points Info(tddftlr): 231 of 512 k-points Info(tddftlr): 488 of 512 k-points Info(tddftlr): 232 of 512 k-points Info(tddftlr): 489 of 512 k-points Info(tddftlr): 233 of 512 k-points Info(tddftlr): 490 of 512 k-points Info(tddftlr): 234 of 512 k-points Info(tddftlr): 491 of 512 k-points Info(tddftlr): 235 of 512 k-points Info(tddftlr): 492 of 512 k-points Info(tddftlr): 236 of 512 k-points Info(tddftlr): 493 of 512 k-points Info(tddftlr): 237 of 512 k-points Info(tddftlr): 494 of 512 k-points Info(tddftlr): 238 of 512 k-points Info(tddftlr): 495 of 512 k-points Info(tddftlr): 239 of 512 k-points Info(tddftlr): 496 of 512 k-points Info(tddftlr): 240 of 512 k-points Info(tddftlr): 497 of 512 k-points Info(tddftlr): 241 of 512 k-points Info(tddftlr): 498 of 512 k-points Info(tddftlr): 242 of 512 k-points Info(tddftlr): 499 of 512 k-points Info(tddftlr): 500 of 512 k-points Info(tddftlr): 243 of 512 k-points Info(tddftlr): 501 of 512 k-points Info(tddftlr): 244 of 512 k-points Info(tddftlr): 502 of 512 k-points Info(tddftlr): 245 of 512 k-points Info(tddftlr): 503 of 512 k-points Info(tddftlr): 246 of 512 k-points Info(tddftlr): 504 of 512 k-points Info(tddftlr): 247 of 512 k-points Info(tddftlr): 248 of 512 k-points Info(tddftlr): 505 of 512 k-points Info(tddftlr): 249 of 512 k-points Info(tddftlr): 506 of 512 k-points Info(tddftlr): 250 of 512 k-points Info(tddftlr): 507 of 512 k-points Info(tddftlr): 251 of 512 k-points Info(tddftlr): 508 of 512 k-points Info(tddftlr): 252 of 512 k-points Info(tddftlr): 509 of 512 k-points Info(tddftlr): 253 of 512 k-points Info(tddftlr): 510 of 512 k-points Info(tddftlr): 254 of 512 k-points Info(tddftlr): 511 of 512 k-points Info(tddftlr): 255 of 512 k-points Info(tddftlr): 512 of 512 k-points Info(tddftlr): 256 of 512 k-points Info(tddftlr): done 10 bootstrap iterations head of matrix v.f_xc : 0.3038337507 -0.1432890861E-15 Info(tddftlr): done 20 bootstrap iterations head of matrix v.f_xc : 0.3038347382 -0.1432960200E-15 Info(tddftlr): done 30 bootstrap iterations head of matrix v.f_xc : 0.3038347955 -0.1432972674E-15 Info(tddftlr): Dielectric tensor written to EPSILON_TDDFT_ij.OUT Inverse written to EPSINV_TDDFT_ij.OUT Macroscopic part written to EPSM_TDDFT_ij.OUT for components i = 1, j = 1 q-vector (lattice coordinates) : 0.000000000 0.000000000 0.000000000 q-vector length : 0.000000000 Faraday angle parameters Δδ and Δβ written to FARADAY.OUT MOKE Kerr angle written to KERR_TDDFT.OUT Magnetic linear dichroism (MLD) spectrum written to MLD.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -106.905945872 TEST_000.OUT : -112.112815923 absolute difference : 5.20687005100 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.106905945872E-02 Running test in directory test_024... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 1.6441 Info(checkmt): reduced muffin-tin radius of species 2 (O) from 1.8000 to 1.3452 Info(findsymcrys): atomic basis shift (lattice) : -0.4650000000 0.000000000 0.000000000 See GEOMETRY.OUT for new atomic positions Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 1846 The leading minor of the overlap matrix of order 903 is not positive definite Order of overlap matrix : 943 Running test in directory test_025... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff8a9d6873 in ??? #1 0x7fff8a9d7f43 in ??? #2 0x7fff8a9d99eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Co) from 2.4000 to 2.3401 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 17.71768676 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 18.21525195 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -36.81163286 -4.383400000 for s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 24.91319486 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 17.72944583 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -92.79702568 -4.383400000 for s.c. loop 5 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 32.76746117 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 17.87103457 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 17.55814677 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -322.3614879 -4.383400000 for s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 64.35052636 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 18.02115502 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 17.96681344 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 17.39917671 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 16.99276514 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.274406255 -4.383400000 for s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 16.84968048 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.548963970 -4.383400000 for s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 16.82700365 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.901892730 -4.383400000 for s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 16.80423299 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 18.51613116 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 18.53016091 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 18.48551528 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 18.22792985 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 18.22414104 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 18.39870000 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 18.14373026 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 17.89643311 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 17.88917657 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 17.98838469 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 18.14713553 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.495502997 -4.383400000 for s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 16.61352134 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 18.73381958 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 18.57825633 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 18.68395029 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 18.61535919 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 18.54365018 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 18.55373466 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 18.46476841 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 18.51104088 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 18.49390379 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 18.56273253 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 18.48318398 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 18.51078936 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 18.55087268 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 18.54998385 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 18.55713760 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 18.53119240 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 18.53051968 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 18.54351944 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 18.50329118 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 18.49012998 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 18.47808564 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 18.51109697 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 18.50709648 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 18.52397341 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 18.51362332 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 18.52228756 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 18.55480508 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 18.53080576 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 18.54103129 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 18.51947931 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 18.57979705 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 18.52954464 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 18.50671317 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 18.47325510 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 18.50571209 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 18.48037286 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 18.51390674 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 18.52957752 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 18.50420366 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 18.54852986 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 18.47264501 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 18.49092055 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 18.52709681 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 18.50369040 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 18.51451634 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 18.48392266 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 18.49438349 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 18.51782365 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 18.49492368 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 18.48966661 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 18.47653786 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 18.49457570 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 18.56769095 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 18.52401663 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 18.54586302 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 18.51074540 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 18.48515319 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 18.47364669 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 18.45898569 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 18.49668850 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 18.49042671 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 18.47406295 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 18.47141318 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 18.50604869 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 18.54176281 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 18.54204343 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 18.49360261 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 18.54960701 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 18.56627480 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 18.48874254 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 18.53784668 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 18.51931320 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 18.52236584 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 18.52994491 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 18.53746119 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 18.57109936 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 18.49715345 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 18.51595574 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 18.47868408 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 18.51410458 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 18.51473656 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 18.51630318 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 18.51080212 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 18.49385415 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 18.46983567 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 18.48830876 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 18.50895100 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 18.48898557 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 18.52100125 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 18.57183725 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 18.44229108 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 18.54037799 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 18.54581631 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 18.53846612 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 18.50075797 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 18.51724675 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 18.49567155 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 18.46945802 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 18.51240826 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 18.53443324 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 18.50124785 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 18.50895775 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 18.49685925 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 18.57594919 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 18.57882040 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 18.56507727 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 18.50873921 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 18.52903202 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 18.53340123 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 18.52844855 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 18.53099395 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 18.54128461 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 18.52609846 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 18.54118237 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 18.56059914 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 18.57179158 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 18.52824225 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 18.45245904 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 18.43509293 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 18.46065502 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 18.49422121 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 18.51553724 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 18.47436759 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 18.45824163 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 18.47742136 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 18.47614441 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 18.48447160 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 18.45047984 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 18.47007794 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 18.50983753 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 18.53311165 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 18.43023824 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 18.43719662 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 18.51655096 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 18.48609825 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 18.47890613 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 18.46492511 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 18.54778382 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 18.46922378 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 18.49969157 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 18.51840683 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 18.45180847 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 18.53720661 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 18.45387277 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 18.39218868 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 18.45517652 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 18.48487019 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 18.47901314 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 18.46063134 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 18.46193866 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 18.51236871 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 18.50310682 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 18.46669904 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 18.48017281 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 18.44550794 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 18.46908050 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 18.53068087 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 18.48735347 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 18.44681778 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 18.47169910 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 18.44218599 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 18.44560214 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 18.48074925 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 18.46934376 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 18.43699354 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 18.45908229 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 18.48922306 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 18.43465242 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 18.48173049 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 18.40120935 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 18.44803530 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 18.50320245 Required : 27.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 2 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 18.50927594 Required : 27.00000000 Info(elk): current task : 110 Warning(linengy): could not find 2 linearisation energies in s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 18.50889698 Required : 27.00000000 Info(mossbauer): Mossbauer parameters written to MOSSBAUER.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1391.14531329 TEST_000.OUT : -1357.29749942 absolute difference : 33.8478138700 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.139114531329E-01 Running test in directory test_026... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff91096873 in ??? #1 0x7fff91097f43 in ??? #2 0x7fff910999eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.3240 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.143167700 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 64.00952200 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 20.37818754 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 20.51204855 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 20.61186903 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 20.53446831 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 20.37914658 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 19.58981560 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 19.29498000 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.168017432 -4.590500000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 19.00388672 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 19.16422530 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.860931763 -4.590500000 for s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 19.14478015 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.728833182 -4.590500000 for s.c. loop 12 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 19.24724922 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.059010657 -4.590500000 for s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 19.23694478 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 19.15790711 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 19.35053062 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 19.34452047 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.143127489 -4.590500000 for s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 19.00478620 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 19.32817895 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 19.24173509 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 19.23757942 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 19.25555676 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.536833855 -4.590500000 for s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 19.34956825 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 19.12126368 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.372640981 -4.590500000 for s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 19.24271999 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 19.40512175 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 19.24153029 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 19.26409752 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 19.26193811 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 19.32075722 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 19.30604539 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 19.29487548 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 19.43504961 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 19.07597127 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 19.22733213 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 19.47070451 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 19.20027491 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 19.18761946 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 19.31077656 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 19.11952573 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 19.43368159 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 19.23569580 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 19.18847030 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 19.31300520 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 19.29275653 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 19.30062927 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 19.32819372 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 19.39802200 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 19.29746401 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 19.30324095 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 19.34817171 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 19.28432974 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 19.43019847 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 19.46867711 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 19.38684178 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 18.57782548 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 19.35884086 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 19.37321210 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 19.22917008 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 19.30648133 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 19.40619319 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 19.24117835 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 19.31406850 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 19.39323147 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 19.41232636 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 19.25598591 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 19.27593659 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 19.25680702 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 19.53440226 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.214057025 -4.590500000 for s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 18.73178275 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 19.25023666 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 19.27825474 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 19.14334166 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 19.34816611 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 19.22905822 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 19.28886342 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 19.25498771 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 19.31672918 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 19.31223040 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 19.57297762 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 19.05732306 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 19.12291879 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 19.20740520 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 19.32554340 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 19.25486463 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 19.28143476 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 19.28535871 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 19.24070692 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 19.55174045 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 19.17799791 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 19.18231703 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 19.14776465 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 19.15937784 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 19.43339567 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 19.17832136 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 19.26180650 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 19.26050511 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 19.24485305 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 19.23126531 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 19.25527863 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 19.25930772 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 19.25414017 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 19.28462690 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 19.25709381 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 19.34562113 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 19.28037023 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 19.26058679 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 19.45532356 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 19.25048073 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 19.16791822 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 19.27054276 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 19.28837982 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 19.30389760 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 19.30280628 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 19.34481864 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 19.24517871 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 19.33705028 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 19.34106224 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 19.34185570 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 19.32077122 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 19.29905919 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 19.24055040 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 19.37198450 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.300481365 -4.590500000 for s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 19.36046133 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.761396413 -4.590500000 for s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 19.54332949 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 19.67338617 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.642721396 -4.590500000 for s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 19.69158131 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 19.33628618 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 19.20930260 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 19.16293107 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 19.43837235 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 19.36431336 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 19.58030162 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.491430365 -4.590500000 for s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 19.34292313 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 19.25541621 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 19.37396650 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 19.19118628 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 19.24643167 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 19.33997082 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 19.27107953 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.312675978 -4.590500000 for s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 19.56745433 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 19.70743091 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 19.23662096 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 19.29090525 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 19.01307856 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.892524802 -4.590500000 for s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 18.74999627 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 19.26097228 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 19.24661501 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 19.25456552 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 19.06555974 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 19.09322276 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 19.28697911 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 19.32838710 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 19.43644127 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 19.25226643 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 19.35630554 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 19.28540844 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 19.38267012 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 19.29432945 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 19.40334130 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 19.32634502 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 19.40923218 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 19.36997885 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 19.26827996 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 19.42814156 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 19.23037911 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 19.25690791 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 19.31279051 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 19.38404161 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 19.31686012 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 19.31891024 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 19.32983456 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 19.25865186 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 19.47505632 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 19.22423817 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 19.34807329 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 19.34807656 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 19.37682220 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 19.36721931 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 19.35260950 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 19.32281019 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 19.36389162 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 19.34920883 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 19.34699177 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 19.37736560 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 19.38590267 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 19.40200786 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 19.20349947 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 19.55300419 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 19.31106260 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 19.25537532 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 19.29570102 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 19.30575491 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 19.16460213 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 19.23490659 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 19.25180111 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 19.23305115 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 19.23542189 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 19.22328116 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 19.22650613 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 19.22738495 Required : 28.00000000 Info(elk): current task : 170 Info(writeemd): 16 of 29 k-points Info(writeemd): 1 of 29 k-points Info(writeemd): 2 of 29 k-points Info(writeemd): 17 of 29 k-points Info(writeemd): 3 of 29 k-points Info(writeemd): 18 of 29 k-points Info(writeemd): 4 of 29 k-points Info(writeemd): 19 of 29 k-points Info(writeemd): 5 of 29 k-points Info(writeemd): 20 of 29 k-points Info(writeemd): 6 of 29 k-points Info(writeemd): 21 of 29 k-points Info(writeemd): 7 of 29 k-points Info(writeemd): 22 of 29 k-points Info(writeemd): 8 of 29 k-points Info(writeemd): 23 of 29 k-points Info(writeemd): 9 of 29 k-points Info(writeemd): 24 of 29 k-points Info(writeemd): 10 of 29 k-points Info(writeemd): 25 of 29 k-points Info(writeemd): 11 of 29 k-points Info(writeemd): 26 of 29 k-points Info(writeemd): 12 of 29 k-points Info(writeemd): 27 of 29 k-points Info(writeemd): 13 of 29 k-points Info(writeemd): 28 of 29 k-points Info(writeemd): 14 of 29 k-points Info(writeemd): 29 of 29 k-points Info(writeemd): 15 of 29 k-points Info(writeemd): electron momentum density written to EMD.OUT for all H+k-vectors up to |H+k| < hkmax Info(elk): current task : 171 Info(emdplot1d): done 1 of 10 points Info(emdplot1d): done 2 of 10 points Info(emdplot1d): done 3 of 10 points Info(emdplot1d): done 4 of 10 points Info(emdplot1d): done 5 of 10 points Info(emdplot1d): done 6 of 10 points Info(emdplot1d): done 7 of 10 points Info(emdplot1d): done 8 of 10 points Info(emdplot1d): done 9 of 10 points Info(emdplot1d): done 10 of 10 points Info(emdplot): 1D electron momentum density written to EMD1D.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1518.39244482 TEST_000.OUT : -1527.24673373 absolute difference : 8.85428891000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.151839244482E-01 Running test in directory test_027... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 208 Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.4000 to 2.2879 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.4000 to 2.2879 Info(bornechg): working on BEC_S01_A001_P1.OUT Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.2879 to 2.2864 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.2879 to 2.2864 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 369 The leading minor of the overlap matrix of order 171 is not positive definite Order of overlap matrix : 198 Running test in directory test_028... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(findsymcrys): atomic basis shift (lattice) : -0.7316652200 -0.7316652200 0.000000000 See GEOMETRY.OUT for new atomic positions Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 668 The leading minor of the overlap matrix of order 239 is not positive definite Order of overlap matrix : 429 Running test in directory test_029... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffa40e6873 in ??? #1 0x7fffa40e7f43 in ??? #2 0x7fffa40e99eb in ??? #3 0x100d60c7 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Cr) from 2.4000 to 2.3521 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 32.21317517 Required : 48.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 32.21560445 Required : 48.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 32.37524132 Required : 48.00000000 Warning(gndstate): failed to reach self-consistency after 4 loops Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 32.57810571 Required : 48.00000000 Info(elk): current task : 700 Warning(occupyulr): minimum eigenvalue less than minimum linearisation energy : -130.3439325 -4.702000000 for s.c. loop 2 Warning(occupyulr): minimum eigenvalue less than minimum linearisation energy : -127.2097067 -4.702000000 for s.c. loop 3 Warning(gndstulr): failed to reach self-consistency after 4 loops Warning(occupyulr): minimum eigenvalue less than minimum linearisation energy : -144.8491646 -4.702000000 for s.c. loop 4 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -2090.80527682 TEST_000.OUT : -2015.02592572 absolute difference : 75.7793511000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.209080527682E-01 Running test in directory test_030... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ti) from 2.4000 to 2.3082 Info(checkmt): reduced muffin-tin radius of species 2 (C) from 1.8000 to 1.7311 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 21.52255528 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 21.49350993 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 20.71639583 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 23.31579732 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 21.95677278 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 21.36420369 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 21.29740607 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 21.68481352 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 21.93598244 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 21.92166292 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 21.91881580 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 21.93441071 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 21.92316746 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 21.92551166 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 21.93530171 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 21.95689133 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 21.93076428 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 21.93688213 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 21.93573091 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 21.92284955 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 21.92390901 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 21.91766517 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 21.90759735 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 21.94768447 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 21.94033430 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 21.94140570 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 21.93323495 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 21.93727733 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 21.93684538 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 21.94020237 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 21.93199910 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 21.93533294 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 21.93329354 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 21.93191579 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 21.93932088 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 21.93991644 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 21.93684937 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 21.93860722 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 21.93335127 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 21.92507917 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 21.93699630 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 21.93124145 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 21.93388210 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 21.93409141 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 21.93619353 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 21.93660191 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 21.92939352 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 21.92874694 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 21.94657980 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 21.95607841 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 21.92010655 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 21.93659632 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 21.93705782 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 21.93087415 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 21.92691991 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 21.94273043 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 21.93657924 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 21.92762747 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 21.92676500 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 21.95547262 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 21.94773237 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 21.93277702 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 21.93290291 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 21.93877467 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 21.92734663 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 21.92517146 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 21.93329067 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 21.92448182 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 21.93165764 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 21.92514524 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 21.92886456 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 21.92938894 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 21.93588128 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 21.93869917 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 21.92475657 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 21.93142063 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 21.93162512 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 21.92732180 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 21.93717269 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 21.93885653 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 21.93295340 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 21.93328530 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 21.93559529 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 21.93683550 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 21.93120879 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 21.92538358 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 21.94934979 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 21.93899071 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 21.92205933 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 21.93640167 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 21.92741679 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 21.93319266 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 21.92541188 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 21.93376870 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 21.92572563 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 21.93459977 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 21.93096026 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 21.91577447 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 21.92521626 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 21.92368522 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 21.92951482 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 21.92484571 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 21.92542912 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 21.93075857 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 21.93685556 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 21.91489664 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 21.92269344 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 21.92815599 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 21.90796662 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 21.93027354 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 21.96029134 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 21.92645694 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 21.92900906 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 21.93802866 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 21.93656751 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 21.92706534 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 21.93178855 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 21.89468871 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 21.93825970 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 21.92897962 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 21.93213825 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 21.93036209 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 21.92301206 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 21.96602937 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 21.93035790 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 21.92368647 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 21.92988171 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 21.92802724 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 21.96824481 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 21.92980521 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 21.95886195 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 21.93277232 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 21.93458260 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 21.90813551 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 21.97758714 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 21.93402494 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 21.92852733 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 21.92895032 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 21.97202537 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 21.93685558 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 21.93687212 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 21.93928834 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 21.92360647 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 21.92750555 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 21.91345997 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 21.92382063 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 21.93143839 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 21.93821369 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 21.92143441 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 21.94093789 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 21.91635168 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 21.93463195 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 21.93756649 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 21.93774442 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 21.93290610 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 21.93563918 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 21.92655811 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 21.92542853 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 21.92977546 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 21.95664699 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 21.93452558 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 21.93517532 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 21.93794311 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 21.93400592 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 21.93908338 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 21.93659553 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 21.92999239 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 21.90576223 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 21.92225436 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 21.92871888 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 21.93308643 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 21.93207503 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 21.92484430 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 21.93425656 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 21.98477487 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 21.95369918 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 21.93145808 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 21.93329235 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 21.92637359 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 21.92623762 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 21.89747352 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 21.95096438 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 21.92621859 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 21.93781924 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 21.93488432 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 21.93285181 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 21.96820411 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 21.93871485 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 21.92199052 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 21.93216187 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 21.92990154 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 21.92907953 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 21.92198577 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 21.93750129 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 21.93670260 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 21.93439079 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 21.93495627 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 21.93318360 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 21.92719740 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 21.93698057 Required : 28.00000000 Info(elk): current task : 450 Info(genafieldt): Time-dependent A-field written to AFIELDT.OUT Laser pulse and ramp parameters written to TD_INFO.OUT 1 atomic unit of time is 24.18884327 attoseconds Total simulation time : 40.00000000 in attoseconds : 967.5537306 Info(elk): current task : 460 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 249 The leading minor of the overlap matrix of order 118 is not positive definite Order of overlap matrix : 131 real 101m17.190s user 99m24.201s sys 0m33.721s + rm -rf tests tests-libxc + . /etc/profile.d/modules.sh ++ . /etc/profile.d/00-modulepath.sh +++ '[' -z /etc/modulefiles:/usr/share/modulefiles:/usr/share/modulefiles/Linux:/usr/share/modulefiles/Core:/usr/share/lmod/lmod/modulefiles/Core ']' +++ : ++ '[' -z '' ']' ++ LMOD_ALLOW_ROOT_USE=yes ++ '[' -n '' ']' ++ '[' yes '!=' yes ']' ++ '[' -z /usr/share/modulefiles ']' ++ findExec READLINK_CMD /usr/bin/readlink readlink ++ Nm=READLINK_CMD ++ confPath=/usr/bin/readlink ++ execNm=readlink ++ eval READLINK_CMD=/usr/bin/readlink +++ READLINK_CMD=/usr/bin/readlink ++ '[' '!' -x /usr/bin/readlink ']' ++ unset Nm confPath execNm ++ findExec PS_CMD /usr/bin/ps ps ++ Nm=PS_CMD ++ confPath=/usr/bin/ps ++ execNm=ps ++ eval PS_CMD=/usr/bin/ps +++ PS_CMD=/usr/bin/ps ++ '[' '!' -x /usr/bin/ps ']' ++ unset Nm confPath execNm ++ findExec EXPR_CMD /usr/bin/expr expr ++ Nm=EXPR_CMD ++ confPath=/usr/bin/expr ++ execNm=expr ++ eval EXPR_CMD=/usr/bin/expr +++ EXPR_CMD=/usr/bin/expr ++ '[' '!' -x /usr/bin/expr ']' ++ unset Nm confPath execNm ++ findExec BASENAME_CMD /usr/bin/basename basename ++ Nm=BASENAME_CMD ++ confPath=/usr/bin/basename ++ execNm=basename ++ eval BASENAME_CMD=/usr/bin/basename +++ BASENAME_CMD=/usr/bin/basename ++ '[' '!' -x /usr/bin/basename ']' ++ unset Nm confPath execNm ++ unset -f findExec ++ '[' -f /proc/34955/exe ']' +++ /usr/bin/readlink /proc/34955/exe ++ my_shell=/usr/bin/bash +++ /usr/bin/expr /usr/bin/bash : '-*\(.*\)' ++ my_shell=/usr/bin/bash +++ /usr/bin/basename /usr/bin/bash ++ my_shell=bash ++ case ${my_shell} in ++ '[' -f /usr/share/lmod/lmod/init/bash ']' ++ . /usr/share/lmod/lmod/init/bash +++ '[' -z '' ']' +++ case "$-" in +++ __lmod_vx=x +++ '[' -n x ']' +++ set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for this output (/usr/share/lmod/lmod/init/bash) Shell debugging restarted +++ unset __lmod_vx ++ unset my_shell PS_CMD EXPR_CMD BASENAME_CMD MODULEPATH_INIT LMOD_ALLOW_ROOT_USE READLINK_CMD + module unload mpi/openmpi-ppc64le + local __lmod_my_status + local __lmod_sh_dbg + '[' -z '' ']' + case "$-" in + __lmod_sh_dbg=x + '[' -n x ']' + set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for Lmod's output Shell debugging restarted + return 0 + . /etc/profile.d/modules.sh ++ . /etc/profile.d/00-modulepath.sh +++ '[' -z /etc/modulefiles:/usr/share/modulefiles:/usr/share/modulefiles/Linux:/usr/share/modulefiles/Core:/usr/share/lmod/lmod/modulefiles/Core ']' +++ : ++ '[' -z '' ']' ++ LMOD_ALLOW_ROOT_USE=yes ++ '[' -n '' ']' ++ '[' yes '!=' yes ']' ++ '[' -z /usr/share/modulefiles ']' ++ findExec READLINK_CMD /usr/bin/readlink readlink ++ Nm=READLINK_CMD ++ confPath=/usr/bin/readlink ++ execNm=readlink ++ eval READLINK_CMD=/usr/bin/readlink +++ READLINK_CMD=/usr/bin/readlink ++ '[' '!' -x /usr/bin/readlink ']' ++ unset Nm confPath execNm ++ findExec PS_CMD /usr/bin/ps ps ++ Nm=PS_CMD ++ confPath=/usr/bin/ps ++ execNm=ps ++ eval PS_CMD=/usr/bin/ps +++ PS_CMD=/usr/bin/ps ++ '[' '!' -x /usr/bin/ps ']' ++ unset Nm confPath execNm ++ findExec EXPR_CMD /usr/bin/expr expr ++ Nm=EXPR_CMD ++ confPath=/usr/bin/expr ++ execNm=expr ++ eval EXPR_CMD=/usr/bin/expr +++ EXPR_CMD=/usr/bin/expr ++ '[' '!' -x /usr/bin/expr ']' ++ unset Nm confPath execNm ++ findExec BASENAME_CMD /usr/bin/basename basename ++ Nm=BASENAME_CMD ++ confPath=/usr/bin/basename ++ execNm=basename ++ eval BASENAME_CMD=/usr/bin/basename +++ BASENAME_CMD=/usr/bin/basename ++ '[' '!' -x /usr/bin/basename ']' ++ unset Nm confPath execNm ++ unset -f findExec ++ '[' -f /proc/34955/exe ']' +++ /usr/bin/readlink /proc/34955/exe ++ my_shell=/usr/bin/bash +++ /usr/bin/expr /usr/bin/bash : '-*\(.*\)' ++ my_shell=/usr/bin/bash +++ /usr/bin/basename /usr/bin/bash ++ my_shell=bash ++ case ${my_shell} in ++ '[' -f /usr/share/lmod/lmod/init/bash ']' ++ . /usr/share/lmod/lmod/init/bash +++ '[' -z '' ']' +++ case "$-" in +++ __lmod_vx=x +++ '[' -n x ']' +++ set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for this output (/usr/share/lmod/lmod/init/bash) Shell debugging restarted +++ unset __lmod_vx ++ unset my_shell PS_CMD EXPR_CMD BASENAME_CMD MODULEPATH_INIT LMOD_ALLOW_ROOT_USE READLINK_CMD + module load mpi/mpich-ppc64le + local __lmod_my_status + local __lmod_sh_dbg + '[' -z '' ']' + case "$-" in + __lmod_sh_dbg=x + '[' -n x ']' + set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for Lmod's output Shell debugging restarted + return 0 + export 'CFLAGS=-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + CFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m64 -mcpu=power8 -mtune=power8 -fasynchronous-unwind-tables -fstack-clash-protection' + ELK_EXECUTABLE='mpiexec -np 1 ../../elk_mpich' + cp -rp tests-libxc.orig tests-libxc + sed -i 's#../../src/elk#mpiexec -np 1 ../../elk_mpich#g' tests-libxc/test.sh + sed -i '/Failed/ a cat test.log' tests-libxc/test.sh + tee test-libxc.1_mpich.log + /usr/bin/make test-libxc cd tests-libxc; ./test.sh Running test in directory test_001... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Backtrace for this error: Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Backtrace for this error: Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Backtrace for this error: Backtrace for this error: Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Backtrace for this error: Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Backtrace for this error: Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Backtrace for this error: Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Backtrace for this error: Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Backtrace for this error: Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Backtrace for this error: Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.4000 to 2.2888 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.4000 to 2.2888 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 331 The leading minor of the overlap matrix of order 152 is not positive definite Order of overlap matrix : 179 Running test in directory test_002... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffab626873 in ??? #1 0x7fffab627f43 in ??? #2 0x7fffab6299eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.3297 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.888799720 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 26.31722817 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.675521898 -4.590500000 for s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 26.90484021 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 19.67776593 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.688056786 -4.590500000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 28.32716529 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 19.81972006 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 21.36684730 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 19.54962614 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 19.50800222 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 19.29071403 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 19.32307622 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 18.58317445 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 18.15957460 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 19.16085257 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 18.80872892 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 20.07167637 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.667026625 -4.590500000 for s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 17.94189690 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 17 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.911347884 -4.590500000 for s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 20.44256021 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 17.25047333 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 18.47422072 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.655879182 -4.590500000 for s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 18.20535706 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.649407621 -4.590500000 for s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 18.30113949 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 18.74482131 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.889455430 -4.590500000 for s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 18.92654912 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.926054149 -4.590500000 for s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 18.73102676 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.715690217 -4.590500000 for s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 18.83301256 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 18.65875807 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 18.01525923 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.737464927 -4.590500000 for s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 18.89842749 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 19.34507117 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 18.73211444 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.602279783 -4.590500000 for s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 18.66966361 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 18.31493447 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.615514531 -4.590500000 for s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 18.84546032 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.822891942 -4.590500000 for s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 17.29290119 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.796185072 -4.590500000 for s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 18.76945587 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 19.01138781 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 19.16542378 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 18.92438157 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 18.51311823 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.623496311 -4.590500000 for s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 18.52362657 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.769966619 -4.590500000 for s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 18.29164680 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 18.65259800 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.935695465 -4.590500000 for s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 18.34878591 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.613973877 -4.590500000 for s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 18.51709459 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 18.51662198 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 18.48894021 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.597666188 -4.590500000 for s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 18.43169344 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.034120409 -4.590500000 for s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 18.05507046 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.737151669 -4.590500000 for s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 19.48969659 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.861650670 -4.590500000 for s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 18.41438041 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.391883431 -4.590500000 for s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 19.01736659 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.934386297 -4.590500000 for s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 18.46122457 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.672177600 -4.590500000 for s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 18.59473817 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.024053938 -4.590500000 for s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 18.67631432 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 18.68850936 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.741386159 -4.590500000 for s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 18.81544927 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.631181047 -4.590500000 for s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 19.15909265 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.661920964 -4.590500000 for s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 17.90163948 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.569459934 -4.590500000 for s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 18.21887200 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.601926111 -4.590500000 for s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 18.61516176 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 18.65336645 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 18.71471950 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 18.67094538 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 18.85928927 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 18.68206735 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 18.69178990 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.583432677 -4.590500000 for s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 18.63675530 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.608806163 -4.590500000 for s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 18.69598630 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 18.71801379 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.916403554 -4.590500000 for s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 18.70458534 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.052194104 -4.590500000 for s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 18.37518201 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.864037440 -4.590500000 for s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 18.60554722 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.604852820 -4.590500000 for s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 18.70770988 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.092819550 -4.590500000 for s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 18.16741320 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.784418099 -4.590500000 for s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 17.45362577 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 17.94135080 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 18.80713316 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.122262674 -4.590500000 for s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 18.03440706 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.722630813 -4.590500000 for s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 18.63377134 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.054118638 -4.590500000 for s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 18.08911600 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 18.52343784 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.990715349 -4.590500000 for s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 18.36510306 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.773021650 -4.590500000 for s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 18.49488477 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.731202201 -4.590500000 for s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 18.32136458 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.826987807 -4.590500000 for s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 18.25336354 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.791512231 -4.590500000 for s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 18.24418340 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.007858426 -4.590500000 for s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 17.88897534 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.641416205 -4.590500000 for s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 17.14958566 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.716322756 -4.590500000 for s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 17.36317430 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.728651195 -4.590500000 for s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 17.53544747 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.635253263 -4.590500000 for s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 17.49970824 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.015795619 -4.590500000 for s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 18.33083209 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.619833070 -4.590500000 for s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 18.29557978 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.902700062 -4.590500000 for s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 17.40127431 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.734196263 -4.590500000 for s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 17.18807548 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.771273536 -4.590500000 for s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 17.52410199 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 17.39806203 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.077893761 -4.590500000 for s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 17.31388948 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.853659706 -4.590500000 for s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 17.65230382 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.035033332 -4.590500000 for s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 18.07916771 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.019108925 -4.590500000 for s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 18.03225971 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.006194197 -4.590500000 for s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 18.28773596 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 18.69917005 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.842724200 -4.590500000 for s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 18.31086043 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.611509756 -4.590500000 for s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 18.90760040 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.661829186 -4.590500000 for s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 18.95810990 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.628484781 -4.590500000 for s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 18.72043001 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.752470539 -4.590500000 for s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 19.25387026 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.736829738 -4.590500000 for s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 18.59235745 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 18.29584858 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 18.34286293 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.756241220 -4.590500000 for s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 17.46003572 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.907554167 -4.590500000 for s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 17.77717759 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.224870078 -4.590500000 for s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 18.49156534 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.596937930 -4.590500000 for s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 18.73837994 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 18.65620742 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.848559047 -4.590500000 for s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 18.95359318 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.839063729 -4.590500000 for s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 18.36515357 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.695033042 -4.590500000 for s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 17.94081357 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.875351926 -4.590500000 for s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 17.88391894 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.662156660 -4.590500000 for s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 17.31798020 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.071876527 -4.590500000 for s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 17.88827321 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.033480350 -4.590500000 for s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 17.89349054 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.000418484 -4.590500000 for s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 17.32043204 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.646340367 -4.590500000 for s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 17.37289172 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 19.66244943 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.715379458 -4.590500000 for s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 19.68728593 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 20.13292863 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 19.87387580 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 20.06702001 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 19.84461563 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 19.75498387 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 19.81693125 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 19.90918896 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 20.29253784 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 20.32497222 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 20.25967585 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 20.53296724 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 20.54214290 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 20.45398732 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 20.55309972 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 20.58616498 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 20.63038698 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 20.56328934 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 20.68332788 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 20.64442736 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 20.55509933 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 20.44438866 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 20.53584017 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 20.63996745 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 20.60517539 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 20.58275302 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 20.56538318 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 20.53628287 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 20.31671760 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 20.28202074 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 20.37599791 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 20.13170876 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 20.50552265 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 20.48833766 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 20.53586724 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 20.55161119 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 20.57897255 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 20.25579894 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 20.37789379 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 20.55666404 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 20.39135656 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 20.52647489 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 20.44138007 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 20.57677970 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 20.51329831 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 20.44807246 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 20.40305394 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 20.56104581 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 20.49070231 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 20.49890684 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 20.24248198 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 20.33499083 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 20.40062335 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 20.53153999 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 20.47829059 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 20.67203686 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 20.19931287 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 20.46280321 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 19.77862586 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 20.75047044 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 20.68483009 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 20.48250339 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 20.53611630 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 20.55537005 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 20.41484096 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 20.42430936 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 20.36917684 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 20.48422320 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 20.38187544 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 20.51143831 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 20.61977135 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 20.56486268 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 20.43611372 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 20.48488737 Required : 28.00000000 Info(elk): current task : 330 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Info(tddftsplr): 126 of 1000 k-points Info(tddftsplr): 501 of 1000 k-points Info(tddftsplr): 751 of 1000 k-points Info(tddftsplr): 1 of 1000 k-points Info(tddftsplr): 626 of 1000 k-points Info(tddftsplr): 376 of 1000 k-points Info(tddftsplr): 251 of 1000 k-points Info(tddftsplr): 876 of 1000 k-points Info(tddftsplr): 2 of 1000 k-points Info(tddftsplr): 252 of 1000 k-points Info(tddftsplr): 377 of 1000 k-points Info(tddftsplr): 127 of 1000 k-points Info(tddftsplr): 752 of 1000 k-points Info(tddftsplr): 877 of 1000 k-points Info(tddftsplr): 627 of 1000 k-points Info(tddftsplr): 502 of 1000 k-points Info(tddftsplr): 3 of 1000 k-points Info(tddftsplr): 253 of 1000 k-points Info(tddftsplr): 128 of 1000 k-points Info(tddftsplr): 628 of 1000 k-points Info(tddftsplr): 378 of 1000 k-points Info(tddftsplr): 753 of 1000 k-points Info(tddftsplr): 878 of 1000 k-points Info(tddftsplr): 503 of 1000 k-points Info(tddftsplr): 254 of 1000 k-points Info(tddftsplr): 4 of 1000 k-points Info(tddftsplr): 129 of 1000 k-points Info(tddftsplr): 629 of 1000 k-points Info(tddftsplr): 379 of 1000 k-points Info(tddftsplr): 879 of 1000 k-points Info(tddftsplr): 754 of 1000 k-points Info(tddftsplr): 504 of 1000 k-points Info(tddftsplr): 255 of 1000 k-points Info(tddftsplr): 5 of 1000 k-points Info(tddftsplr): 130 of 1000 k-points Info(tddftsplr): 630 of 1000 k-points Info(tddftsplr): 380 of 1000 k-points Info(tddftsplr): 880 of 1000 k-points Info(tddftsplr): 755 of 1000 k-points Info(tddftsplr): 505 of 1000 k-points Info(tddftsplr): 256 of 1000 k-points Info(tddftsplr): 6 of 1000 k-points Info(tddftsplr): 631 of 1000 k-points Info(tddftsplr): 131 of 1000 k-points Info(tddftsplr): 381 of 1000 k-points Info(tddftsplr): 756 of 1000 k-points Info(tddftsplr): 506 of 1000 k-points Info(tddftsplr): 881 of 1000 k-points Info(tddftsplr): 257 of 1000 k-points Info(tddftsplr): 7 of 1000 k-points Info(tddftsplr): 632 of 1000 k-points Info(tddftsplr): 757 of 1000 k-points Info(tddftsplr): 132 of 1000 k-points Info(tddftsplr): 382 of 1000 k-points Info(tddftsplr): 882 of 1000 k-points Info(tddftsplr): 8 of 1000 k-points Info(tddftsplr): 258 of 1000 k-points Info(tddftsplr): 507 of 1000 k-points Info(tddftsplr): 633 of 1000 k-points Info(tddftsplr): 133 of 1000 k-points Info(tddftsplr): 758 of 1000 k-points Info(tddftsplr): 383 of 1000 k-points Info(tddftsplr): 883 of 1000 k-points Info(tddftsplr): 508 of 1000 k-points Info(tddftsplr): 9 of 1000 k-points Info(tddftsplr): 259 of 1000 k-points Info(tddftsplr): 634 of 1000 k-points Info(tddftsplr): 884 of 1000 k-points Info(tddftsplr): 384 of 1000 k-points Info(tddftsplr): 134 of 1000 k-points Info(tddftsplr): 759 of 1000 k-points Info(tddftsplr): 509 of 1000 k-points Info(tddftsplr): 10 of 1000 k-points Info(tddftsplr): 635 of 1000 k-points Info(tddftsplr): 260 of 1000 k-points Info(tddftsplr): 135 of 1000 k-points Info(tddftsplr): 885 of 1000 k-points Info(tddftsplr): 760 of 1000 k-points Info(tddftsplr): 385 of 1000 k-points Info(tddftsplr): 510 of 1000 k-points Info(tddftsplr): 11 of 1000 k-points Info(tddftsplr): 136 of 1000 k-points Info(tddftsplr): 261 of 1000 k-points Info(tddftsplr): 636 of 1000 k-points Info(tddftsplr): 886 of 1000 k-points Info(tddftsplr): 761 of 1000 k-points Info(tddftsplr): 386 of 1000 k-points Info(tddftsplr): 12 of 1000 k-points Info(tddftsplr): 511 of 1000 k-points Info(tddftsplr): 262 of 1000 k-points Info(tddftsplr): 137 of 1000 k-points Info(tddftsplr): 637 of 1000 k-points Info(tddftsplr): 762 of 1000 k-points Info(tddftsplr): 887 of 1000 k-points Info(tddftsplr): 512 of 1000 k-points Info(tddftsplr): 387 of 1000 k-points Info(tddftsplr): 13 of 1000 k-points Info(tddftsplr): 138 of 1000 k-points Info(tddftsplr): 263 of 1000 k-points Info(tddftsplr): 888 of 1000 k-points Info(tddftsplr): 638 of 1000 k-points Info(tddftsplr): 388 of 1000 k-points Info(tddftsplr): 763 of 1000 k-points Info(tddftsplr): 513 of 1000 k-points Info(tddftsplr): 14 of 1000 k-points Info(tddftsplr): 139 of 1000 k-points Info(tddftsplr): 264 of 1000 k-points Info(tddftsplr): 889 of 1000 k-points Info(tddftsplr): 639 of 1000 k-points Info(tddftsplr): 389 of 1000 k-points Info(tddftsplr): 764 of 1000 k-points Info(tddftsplr): 140 of 1000 k-points Info(tddftsplr): 15 of 1000 k-points Info(tddftsplr): 514 of 1000 k-points Info(tddftsplr): 265 of 1000 k-points Info(tddftsplr): 890 of 1000 k-points Info(tddftsplr): 765 of 1000 k-points Info(tddftsplr): 640 of 1000 k-points Info(tddftsplr): 390 of 1000 k-points Info(tddftsplr): 141 of 1000 k-points Info(tddftsplr): 16 of 1000 k-points Info(tddftsplr): 515 of 1000 k-points Info(tddftsplr): 266 of 1000 k-points Info(tddftsplr): 766 of 1000 k-points Info(tddftsplr): 641 of 1000 k-points Info(tddftsplr): 891 of 1000 k-points Info(tddftsplr): 142 of 1000 k-points Info(tddftsplr): 17 of 1000 k-points Info(tddftsplr): 267 of 1000 k-points Info(tddftsplr): 391 of 1000 k-points Info(tddftsplr): 516 of 1000 k-points Info(tddftsplr): 767 of 1000 k-points Info(tddftsplr): 642 of 1000 k-points Info(tddftsplr): 892 of 1000 k-points Info(tddftsplr): 768 of 1000 k-points Info(tddftsplr): 143 of 1000 k-points Info(tddftsplr): 268 of 1000 k-points Info(tddftsplr): 18 of 1000 k-points Info(tddftsplr): 392 of 1000 k-points Info(tddftsplr): 517 of 1000 k-points Info(tddftsplr): 643 of 1000 k-points Info(tddftsplr): 893 of 1000 k-points Info(tddftsplr): 144 of 1000 k-points Info(tddftsplr): 269 of 1000 k-points Info(tddftsplr): 19 of 1000 k-points Info(tddftsplr): 518 of 1000 k-points Info(tddftsplr): 393 of 1000 k-points Info(tddftsplr): 769 of 1000 k-points Info(tddftsplr): 644 of 1000 k-points Info(tddftsplr): 894 of 1000 k-points Info(tddftsplr): 519 of 1000 k-points Info(tddftsplr): 145 of 1000 k-points Info(tddftsplr): 770 of 1000 k-points Info(tddftsplr): 20 of 1000 k-points Info(tddftsplr): 270 of 1000 k-points Info(tddftsplr): 394 of 1000 k-points Info(tddftsplr): 895 of 1000 k-points Info(tddftsplr): 146 of 1000 k-points Info(tddftsplr): 645 of 1000 k-points Info(tddftsplr): 21 of 1000 k-points Info(tddftsplr): 520 of 1000 k-points Info(tddftsplr): 395 of 1000 k-points Info(tddftsplr): 271 of 1000 k-points Info(tddftsplr): 771 of 1000 k-points Info(tddftsplr): 896 of 1000 k-points Info(tddftsplr): 147 of 1000 k-points Info(tddftsplr): 22 of 1000 k-points Info(tddftsplr): 521 of 1000 k-points Info(tddftsplr): 646 of 1000 k-points Info(tddftsplr): 272 of 1000 k-points Info(tddftsplr): 396 of 1000 k-points Info(tddftsplr): 772 of 1000 k-points Info(tddftsplr): 148 of 1000 k-points Info(tddftsplr): 522 of 1000 k-points Info(tddftsplr): 647 of 1000 k-points Info(tddftsplr): 23 of 1000 k-points Info(tddftsplr): 897 of 1000 k-points Info(tddftsplr): 397 of 1000 k-points Info(tddftsplr): 273 of 1000 k-points Info(tddftsplr): 773 of 1000 k-points Info(tddftsplr): 149 of 1000 k-points Info(tddftsplr): 523 of 1000 k-points Info(tddftsplr): 648 of 1000 k-points Info(tddftsplr): 898 of 1000 k-points Info(tddftsplr): 24 of 1000 k-points Info(tddftsplr): 398 of 1000 k-points Info(tddftsplr): 274 of 1000 k-points Info(tddftsplr): 774 of 1000 k-points Info(tddftsplr): 150 of 1000 k-points Info(tddftsplr): 649 of 1000 k-points Info(tddftsplr): 524 of 1000 k-points Info(tddftsplr): 899 of 1000 k-points Info(tddftsplr): 25 of 1000 k-points Info(tddftsplr): 275 of 1000 k-points Info(tddftsplr): 151 of 1000 k-points Info(tddftsplr): 399 of 1000 k-points Info(tddftsplr): 650 of 1000 k-points Info(tddftsplr): 525 of 1000 k-points Info(tddftsplr): 900 of 1000 k-points Info(tddftsplr): 775 of 1000 k-points Info(tddftsplr): 276 of 1000 k-points Info(tddftsplr): 152 of 1000 k-points Info(tddftsplr): 26 of 1000 k-points Info(tddftsplr): 400 of 1000 k-points Info(tddftsplr): 651 of 1000 k-points Info(tddftsplr): 526 of 1000 k-points Info(tddftsplr): 901 of 1000 k-points Info(tddftsplr): 776 of 1000 k-points Info(tddftsplr): 153 of 1000 k-points Info(tddftsplr): 401 of 1000 k-points Info(tddftsplr): 27 of 1000 k-points Info(tddftsplr): 902 of 1000 k-points Info(tddftsplr): 277 of 1000 k-points Info(tddftsplr): 652 of 1000 k-points Info(tddftsplr): 527 of 1000 k-points Info(tddftsplr): 154 of 1000 k-points Info(tddftsplr): 777 of 1000 k-points Info(tddftsplr): 402 of 1000 k-points Info(tddftsplr): 28 of 1000 k-points Info(tddftsplr): 653 of 1000 k-points Info(tddftsplr): 278 of 1000 k-points Info(tddftsplr): 903 of 1000 k-points Info(tddftsplr): 528 of 1000 k-points Info(tddftsplr): 155 of 1000 k-points Info(tddftsplr): 29 of 1000 k-points Info(tddftsplr): 654 of 1000 k-points Info(tddftsplr): 778 of 1000 k-points Info(tddftsplr): 279 of 1000 k-points Info(tddftsplr): 403 of 1000 k-points Info(tddftsplr): 904 of 1000 k-points Info(tddftsplr): 529 of 1000 k-points Info(tddftsplr): 156 of 1000 k-points Info(tddftsplr): 30 of 1000 k-points Info(tddftsplr): 779 of 1000 k-points Info(tddftsplr): 280 of 1000 k-points Info(tddftsplr): 404 of 1000 k-points Info(tddftsplr): 655 of 1000 k-points Info(tddftsplr): 905 of 1000 k-points Info(tddftsplr): 530 of 1000 k-points Info(tddftsplr): 157 of 1000 k-points Info(tddftsplr): 31 of 1000 k-points Info(tddftsplr): 780 of 1000 k-points Info(tddftsplr): 656 of 1000 k-points Info(tddftsplr): 531 of 1000 k-points Info(tddftsplr): 281 of 1000 k-points Info(tddftsplr): 405 of 1000 k-points Info(tddftsplr): 158 of 1000 k-points Info(tddftsplr): 906 of 1000 k-points Info(tddftsplr): 32 of 1000 k-points Info(tddftsplr): 532 of 1000 k-points Info(tddftsplr): 282 of 1000 k-points Info(tddftsplr): 781 of 1000 k-points Info(tddftsplr): 406 of 1000 k-points Info(tddftsplr): 657 of 1000 k-points Info(tddftsplr): 907 of 1000 k-points Info(tddftsplr): 159 of 1000 k-points Info(tddftsplr): 33 of 1000 k-points Info(tddftsplr): 283 of 1000 k-points Info(tddftsplr): 533 of 1000 k-points Info(tddftsplr): 407 of 1000 k-points Info(tddftsplr): 782 of 1000 k-points Info(tddftsplr): 658 of 1000 k-points Info(tddftsplr): 908 of 1000 k-points Info(tddftsplr): 34 of 1000 k-points Info(tddftsplr): 160 of 1000 k-points Info(tddftsplr): 284 of 1000 k-points Info(tddftsplr): 534 of 1000 k-points Info(tddftsplr): 408 of 1000 k-points Info(tddftsplr): 659 of 1000 k-points Info(tddftsplr): 783 of 1000 k-points Info(tddftsplr): 909 of 1000 k-points Info(tddftsplr): 35 of 1000 k-points Info(tddftsplr): 161 of 1000 k-points Info(tddftsplr): 535 of 1000 k-points Info(tddftsplr): 285 of 1000 k-points Info(tddftsplr): 409 of 1000 k-points Info(tddftsplr): 660 of 1000 k-points Info(tddftsplr): 784 of 1000 k-points Info(tddftsplr): 36 of 1000 k-points Info(tddftsplr): 162 of 1000 k-points Info(tddftsplr): 910 of 1000 k-points Info(tddftsplr): 410 of 1000 k-points Info(tddftsplr): 286 of 1000 k-points Info(tddftsplr): 536 of 1000 k-points Info(tddftsplr): 785 of 1000 k-points Info(tddftsplr): 37 of 1000 k-points Info(tddftsplr): 911 of 1000 k-points Info(tddftsplr): 661 of 1000 k-points Info(tddftsplr): 163 of 1000 k-points Info(tddftsplr): 287 of 1000 k-points Info(tddftsplr): 411 of 1000 k-points Info(tddftsplr): 537 of 1000 k-points Info(tddftsplr): 786 of 1000 k-points Info(tddftsplr): 38 of 1000 k-points Info(tddftsplr): 662 of 1000 k-points Info(tddftsplr): 912 of 1000 k-points Info(tddftsplr): 164 of 1000 k-points Info(tddftsplr): 412 of 1000 k-points Info(tddftsplr): 288 of 1000 k-points Info(tddftsplr): 538 of 1000 k-points Info(tddftsplr): 787 of 1000 k-points Info(tddftsplr): 39 of 1000 k-points Info(tddftsplr): 663 of 1000 k-points Info(tddftsplr): 913 of 1000 k-points Info(tddftsplr): 165 of 1000 k-points Info(tddftsplr): 413 of 1000 k-points Info(tddftsplr): 289 of 1000 k-points Info(tddftsplr): 539 of 1000 k-points Info(tddftsplr): 40 of 1000 k-points Info(tddftsplr): 788 of 1000 k-points Info(tddftsplr): 664 of 1000 k-points Info(tddftsplr): 914 of 1000 k-points Info(tddftsplr): 166 of 1000 k-points Info(tddftsplr): 414 of 1000 k-points Info(tddftsplr): 540 of 1000 k-points Info(tddftsplr): 290 of 1000 k-points Info(tddftsplr): 41 of 1000 k-points Info(tddftsplr): 789 of 1000 k-points Info(tddftsplr): 915 of 1000 k-points Info(tddftsplr): 665 of 1000 k-points Info(tddftsplr): 42 of 1000 k-points Info(tddftsplr): 415 of 1000 k-points Info(tddftsplr): 167 of 1000 k-points Info(tddftsplr): 541 of 1000 k-points Info(tddftsplr): 291 of 1000 k-points Info(tddftsplr): 790 of 1000 k-points Info(tddftsplr): 916 of 1000 k-points Info(tddftsplr): 666 of 1000 k-points Info(tddftsplr): 43 of 1000 k-points Info(tddftsplr): 416 of 1000 k-points Info(tddftsplr): 168 of 1000 k-points Info(tddftsplr): 292 of 1000 k-points Info(tddftsplr): 542 of 1000 k-points Info(tddftsplr): 917 of 1000 k-points Info(tddftsplr): 791 of 1000 k-points Info(tddftsplr): 44 of 1000 k-points Info(tddftsplr): 667 of 1000 k-points Info(tddftsplr): 417 of 1000 k-points Info(tddftsplr): 918 of 1000 k-points Info(tddftsplr): 543 of 1000 k-points Info(tddftsplr): 293 of 1000 k-points Info(tddftsplr): 169 of 1000 k-points Info(tddftsplr): 792 of 1000 k-points Info(tddftsplr): 45 of 1000 k-points Info(tddftsplr): 418 of 1000 k-points Info(tddftsplr): 919 of 1000 k-points Info(tddftsplr): 668 of 1000 k-points Info(tddftsplr): 294 of 1000 k-points Info(tddftsplr): 544 of 1000 k-points Info(tddftsplr): 793 of 1000 k-points Info(tddftsplr): 170 of 1000 k-points Info(tddftsplr): 46 of 1000 k-points Info(tddftsplr): 419 of 1000 k-points Info(tddftsplr): 920 of 1000 k-points Info(tddftsplr): 545 of 1000 k-points Info(tddftsplr): 295 of 1000 k-points Info(tddftsplr): 669 of 1000 k-points Info(tddftsplr): 47 of 1000 k-points Info(tddftsplr): 794 of 1000 k-points Info(tddftsplr): 171 of 1000 k-points Info(tddftsplr): 921 of 1000 k-points Info(tddftsplr): 420 of 1000 k-points Info(tddftsplr): 546 of 1000 k-points Info(tddftsplr): 48 of 1000 k-points Info(tddftsplr): 296 of 1000 k-points Info(tddftsplr): 670 of 1000 k-points Info(tddftsplr): 922 of 1000 k-points Info(tddftsplr): 172 of 1000 k-points Info(tddftsplr): 795 of 1000 k-points Info(tddftsplr): 421 of 1000 k-points Info(tddftsplr): 49 of 1000 k-points Info(tddftsplr): 547 of 1000 k-points Info(tddftsplr): 796 of 1000 k-points Info(tddftsplr): 671 of 1000 k-points Info(tddftsplr): 297 of 1000 k-points Info(tddftsplr): 173 of 1000 k-points Info(tddftsplr): 923 of 1000 k-points Info(tddftsplr): 422 of 1000 k-points Info(tddftsplr): 548 of 1000 k-points Info(tddftsplr): 50 of 1000 k-points Info(tddftsplr): 797 of 1000 k-points Info(tddftsplr): 672 of 1000 k-points Info(tddftsplr): 298 of 1000 k-points Info(tddftsplr): 174 of 1000 k-points Info(tddftsplr): 924 of 1000 k-points Info(tddftsplr): 423 of 1000 k-points Info(tddftsplr): 51 of 1000 k-points Info(tddftsplr): 549 of 1000 k-points Info(tddftsplr): 299 of 1000 k-points Info(tddftsplr): 673 of 1000 k-points Info(tddftsplr): 798 of 1000 k-points Info(tddftsplr): 424 of 1000 k-points Info(tddftsplr): 175 of 1000 k-points Info(tddftsplr): 925 of 1000 k-points Info(tddftsplr): 52 of 1000 k-points Info(tddftsplr): 550 of 1000 k-points Info(tddftsplr): 799 of 1000 k-points Info(tddftsplr): 674 of 1000 k-points Info(tddftsplr): 300 of 1000 k-points Info(tddftsplr): 926 of 1000 k-points Info(tddftsplr): 425 of 1000 k-points Info(tddftsplr): 176 of 1000 k-points Info(tddftsplr): 53 of 1000 k-points Info(tddftsplr): 551 of 1000 k-points Info(tddftsplr): 800 of 1000 k-points Info(tddftsplr): 927 of 1000 k-points Info(tddftsplr): 675 of 1000 k-points Info(tddftsplr): 301 of 1000 k-points Info(tddftsplr): 177 of 1000 k-points Info(tddftsplr): 426 of 1000 k-points Info(tddftsplr): 552 of 1000 k-points Info(tddftsplr): 54 of 1000 k-points Info(tddftsplr): 801 of 1000 k-points Info(tddftsplr): 928 of 1000 k-points Info(tddftsplr): 676 of 1000 k-points Info(tddftsplr): 427 of 1000 k-points Info(tddftsplr): 302 of 1000 k-points Info(tddftsplr): 178 of 1000 k-points Info(tddftsplr): 553 of 1000 k-points Info(tddftsplr): 55 of 1000 k-points Info(tddftsplr): 802 of 1000 k-points Info(tddftsplr): 677 of 1000 k-points Info(tddftsplr): 428 of 1000 k-points Info(tddftsplr): 929 of 1000 k-points Info(tddftsplr): 303 of 1000 k-points Info(tddftsplr): 554 of 1000 k-points Info(tddftsplr): 179 of 1000 k-points Info(tddftsplr): 56 of 1000 k-points Info(tddftsplr): 803 of 1000 k-points Info(tddftsplr): 429 of 1000 k-points Info(tddftsplr): 304 of 1000 k-points Info(tddftsplr): 930 of 1000 k-points Info(tddftsplr): 678 of 1000 k-points Info(tddftsplr): 555 of 1000 k-points Info(tddftsplr): 180 of 1000 k-points Info(tddftsplr): 804 of 1000 k-points Info(tddftsplr): 57 of 1000 k-points Info(tddftsplr): 679 of 1000 k-points Info(tddftsplr): 931 of 1000 k-points Info(tddftsplr): 430 of 1000 k-points Info(tddftsplr): 556 of 1000 k-points Info(tddftsplr): 305 of 1000 k-points Info(tddftsplr): 181 of 1000 k-points Info(tddftsplr): 805 of 1000 k-points Info(tddftsplr): 58 of 1000 k-points Info(tddftsplr): 932 of 1000 k-points Info(tddftsplr): 680 of 1000 k-points Info(tddftsplr): 431 of 1000 k-points Info(tddftsplr): 306 of 1000 k-points Info(tddftsplr): 59 of 1000 k-points Info(tddftsplr): 806 of 1000 k-points Info(tddftsplr): 557 of 1000 k-points Info(tddftsplr): 933 of 1000 k-points Info(tddftsplr): 182 of 1000 k-points Info(tddftsplr): 432 of 1000 k-points Info(tddftsplr): 681 of 1000 k-points Info(tddftsplr): 60 of 1000 k-points Info(tddftsplr): 307 of 1000 k-points Info(tddftsplr): 807 of 1000 k-points Info(tddftsplr): 558 of 1000 k-points Info(tddftsplr): 183 of 1000 k-points Info(tddftsplr): 934 of 1000 k-points Info(tddftsplr): 433 of 1000 k-points Info(tddftsplr): 682 of 1000 k-points Info(tddftsplr): 61 of 1000 k-points Info(tddftsplr): 308 of 1000 k-points Info(tddftsplr): 184 of 1000 k-points Info(tddftsplr): 559 of 1000 k-points Info(tddftsplr): 808 of 1000 k-points Info(tddftsplr): 434 of 1000 k-points Info(tddftsplr): 935 of 1000 k-points Info(tddftsplr): 683 of 1000 k-points Info(tddftsplr): 185 of 1000 k-points Info(tddftsplr): 309 of 1000 k-points Info(tddftsplr): 62 of 1000 k-points Info(tddftsplr): 560 of 1000 k-points Info(tddftsplr): 809 of 1000 k-points Info(tddftsplr): 936 of 1000 k-points Info(tddftsplr): 684 of 1000 k-points Info(tddftsplr): 435 of 1000 k-points Info(tddftsplr): 63 of 1000 k-points Info(tddftsplr): 186 of 1000 k-points Info(tddftsplr): 310 of 1000 k-points Info(tddftsplr): 810 of 1000 k-points Info(tddftsplr): 561 of 1000 k-points Info(tddftsplr): 937 of 1000 k-points Info(tddftsplr): 685 of 1000 k-points Info(tddftsplr): 436 of 1000 k-points Info(tddftsplr): 187 of 1000 k-points Info(tddftsplr): 311 of 1000 k-points Info(tddftsplr): 64 of 1000 k-points Info(tddftsplr): 938 of 1000 k-points Info(tddftsplr): 811 of 1000 k-points Info(tddftsplr): 562 of 1000 k-points Info(tddftsplr): 686 of 1000 k-points Info(tddftsplr): 312 of 1000 k-points Info(tddftsplr): 188 of 1000 k-points Info(tddftsplr): 437 of 1000 k-points Info(tddftsplr): 65 of 1000 k-points Info(tddftsplr): 939 of 1000 k-points Info(tddftsplr): 563 of 1000 k-points Info(tddftsplr): 812 of 1000 k-points Info(tddftsplr): 189 of 1000 k-points Info(tddftsplr): 313 of 1000 k-points Info(tddftsplr): 687 of 1000 k-points Info(tddftsplr): 438 of 1000 k-points Info(tddftsplr): 564 of 1000 k-points Info(tddftsplr): 66 of 1000 k-points Info(tddftsplr): 940 of 1000 k-points Info(tddftsplr): 813 of 1000 k-points Info(tddftsplr): 314 of 1000 k-points Info(tddftsplr): 439 of 1000 k-points Info(tddftsplr): 688 of 1000 k-points Info(tddftsplr): 190 of 1000 k-points Info(tddftsplr): 941 of 1000 k-points Info(tddftsplr): 565 of 1000 k-points Info(tddftsplr): 67 of 1000 k-points Info(tddftsplr): 315 of 1000 k-points Info(tddftsplr): 814 of 1000 k-points Info(tddftsplr): 440 of 1000 k-points Info(tddftsplr): 689 of 1000 k-points Info(tddftsplr): 942 of 1000 k-points Info(tddftsplr): 191 of 1000 k-points Info(tddftsplr): 566 of 1000 k-points Info(tddftsplr): 68 of 1000 k-points Info(tddftsplr): 316 of 1000 k-points Info(tddftsplr): 815 of 1000 k-points Info(tddftsplr): 441 of 1000 k-points Info(tddftsplr): 690 of 1000 k-points Info(tddftsplr): 943 of 1000 k-points Info(tddftsplr): 192 of 1000 k-points Info(tddftsplr): 69 of 1000 k-points Info(tddftsplr): 567 of 1000 k-points Info(tddftsplr): 317 of 1000 k-points Info(tddftsplr): 816 of 1000 k-points Info(tddftsplr): 442 of 1000 k-points 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k-points Info(tddftsplr): 77 of 1000 k-points Info(tddftsplr): 951 of 1000 k-points Info(tddftsplr): 199 of 1000 k-points Info(tddftsplr): 449 of 1000 k-points Info(tddftsplr): 575 of 1000 k-points Info(tddftsplr): 698 of 1000 k-points Info(tddftsplr): 325 of 1000 k-points Info(tddftsplr): 823 of 1000 k-points Info(tddftsplr): 78 of 1000 k-points Info(tddftsplr): 952 of 1000 k-points Info(tddftsplr): 450 of 1000 k-points Info(tddftsplr): 200 of 1000 k-points Info(tddftsplr): 326 of 1000 k-points Info(tddftsplr): 699 of 1000 k-points Info(tddftsplr): 824 of 1000 k-points Info(tddftsplr): 576 of 1000 k-points Info(tddftsplr): 79 of 1000 k-points Info(tddftsplr): 953 of 1000 k-points Info(tddftsplr): 451 of 1000 k-points Info(tddftsplr): 201 of 1000 k-points Info(tddftsplr): 700 of 1000 k-points Info(tddftsplr): 327 of 1000 k-points Info(tddftsplr): 825 of 1000 k-points Info(tddftsplr): 577 of 1000 k-points Info(tddftsplr): 80 of 1000 k-points Info(tddftsplr): 954 of 1000 k-points 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Info(tddftsplr): 243 of 1000 k-points Info(tddftsplr): 621 of 1000 k-points Info(tddftsplr): 743 of 1000 k-points Info(tddftsplr): 370 of 1000 k-points Info(tddftsplr): 997 of 1000 k-points Info(tddftsplr): 868 of 1000 k-points Info(tddftsplr): 124 of 1000 k-points Info(tddftsplr): 496 of 1000 k-points Info(tddftsplr): 244 of 1000 k-points Info(tddftsplr): 622 of 1000 k-points Info(tddftsplr): 744 of 1000 k-points Info(tddftsplr): 371 of 1000 k-points Info(tddftsplr): 998 of 1000 k-points Info(tddftsplr): 869 of 1000 k-points Info(tddftsplr): 125 of 1000 k-points Info(tddftsplr): 497 of 1000 k-points Info(tddftsplr): 245 of 1000 k-points Info(tddftsplr): 623 of 1000 k-points Info(tddftsplr): 745 of 1000 k-points Info(tddftsplr): 372 of 1000 k-points Info(tddftsplr): 999 of 1000 k-points Info(tddftsplr): 870 of 1000 k-points Info(tddftsplr): 498 of 1000 k-points Info(tddftsplr): 246 of 1000 k-points Info(tddftsplr): 624 of 1000 k-points Info(tddftsplr): 746 of 1000 k-points Info(tddftsplr): 373 of 1000 k-points Info(tddftsplr): 871 of 1000 k-points Info(tddftsplr): 1000 of 1000 k-points Info(tddftsplr): 499 of 1000 k-points Info(tddftsplr): 625 of 1000 k-points Info(tddftsplr): 247 of 1000 k-points Info(tddftsplr): 747 of 1000 k-points Info(tddftsplr): 374 of 1000 k-points Info(tddftsplr): 872 of 1000 k-points Info(tddftsplr): 500 of 1000 k-points Info(tddftsplr): 248 of 1000 k-points Info(tddftsplr): 748 of 1000 k-points Info(tddftsplr): 375 of 1000 k-points Info(tddftsplr): 873 of 1000 k-points Info(tddftsplr): 249 of 1000 k-points Info(tddftsplr): 749 of 1000 k-points Info(tddftsplr): 874 of 1000 k-points Info(tddftsplr): 750 of 1000 k-points Info(tddftsplr): 875 of 1000 k-points Info(tddftsplr): 250 of 1000 k-points Info(tddftsplr): Spin-dependent response function chi_ij(G,G',q,w) written to CHI_ij.OUT for i,j = 0-3; G = G' = 0; and all wplot frequencies q-vector (lattice coordinates) : 0.1000000000 0.3000000000 0.000000000 q-vector length : 0.4621801190 The elements of chi labeled by (i,j) form the 4x4 matrix : (_|_ _ _) chi(G,G',q,w) = ( | ) ( | ) ( | ) (0,0) is the charge-charge response drho/dv (0,1-3) is the charge-magnetisation response drho/dB (1-3,0) is the magnetisation-charge response dm/v (1-3,1-3) is the magnetisation-magnetisation response dm/dB Non-interacting Kohn-Sham reponse function written to CHI0_ij.OUT Transverse components corresponding to m_+- = m_x +- im_y written to CHI_T.OUT and CHI0_T.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1517.12685504 TEST_000.OUT : -1465.50710643 absolute difference : 51.6197486100 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.151712685504E-01 Running test in directory test_003... Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Backtrace for this error: Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.2310 Info(checkmt): reduced muffin-tin radius of species 2 (Co) from 2.4000 to 2.2310 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 208 The leading minor of the overlap matrix of order 89 is not positive definite Order of overlap matrix : 119 Running test in directory test_004... ERROR STOP Error termination. Backtrace: #0 0x7fffaca76873 in ??? #1 0x7fffaca77f43 in ??? #2 0x7fffaca799eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.24661092 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.24999501 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.41698933 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.51176029 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.54006153 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.54593224 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.54703537 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.54712565 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.54741584 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.54752245 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 25.54757106 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 25.54754839 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 25.54753970 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 25.54753980 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 25.54753997 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 25.54753999 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 25.54753999 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 25.54754001 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 25.54754000 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 25.54754001 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 25.54754000 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 25.54754000 Required : 28.00000000 Info(elk): current task : 120 Info(genpmat): 5 of 29 k-points Info(genpmat): 1 of 29 k-points Info(genpmat): 9 of 29 k-points Info(genpmat): 27 of 29 k-points Info(genpmat): 13 of 29 k-points Info(genpmat): 17 of 29 k-points Info(genpmat): 21 of 29 k-points Info(genpmat): 24 of 29 k-points Info(genpmat): 22 of 29 k-points Info(genpmat): 2 of 29 k-points Info(genpmat): 25 of 29 k-points Info(genpmat): 14 of 29 k-points Info(genpmat): 28 of 29 k-points Info(genpmat): 18 of 29 k-points Info(genpmat): 10 of 29 k-points Info(genpmat): 6 of 29 k-points Info(genpmat): 3 of 29 k-points Info(genpmat): 23 of 29 k-points Info(genpmat): 15 of 29 k-points Info(genpmat): 29 of 29 k-points Info(genpmat): 26 of 29 k-points Info(genpmat): 11 of 29 k-points Info(genpmat): 19 of 29 k-points Info(genpmat): 7 of 29 k-points Info(genpmat): 12 of 29 k-points Info(genpmat): 16 of 29 k-points Info(genpmat): 20 of 29 k-points Info(genpmat): 4 of 29 k-points Info(genpmat): 8 of 29 k-points Info(writepmat): momentum matrix elements written to file PMAT.OUT Info(elk): current task : 121 Info(dielectric): dielectric tensor written to EPSILON_ij.OUT optical conductivity written to SIGMA_ij.OUT for components i = 1, j = 1 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -538.189221047 TEST_000.OUT : -538.561900080 absolute difference : 0.372679033000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.538189221047E-02 Running test in directory test_005... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffad9a6873 in ??? #1 0x7fffad9a7f43 in ??? #2 0x7fffad9a99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 3 (Cu) from 2.4000 to 1.9694 Info(checkmt): reduced muffin-tin radius of species 4 (O) from 1.8000 to 1.4770 Info(findsymcrys): atomic basis shift (lattice) : -0.5000000000 -0.5000000000 -0.5000000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 330.2427476 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 343.3900266 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 336.6398879 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 375.5905878 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 360.3313653 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 343.5965897 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 984.0569127 Required : 294.0000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 18898.95728 Required : 294.0000000 Warning(linengy): could not find 13 linearisation energies in s.c. loop 9 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -38.54535352 -5.251500000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 128.0115078 Required : 294.0000000 Warning(gndstate): failed to reach self-consistency after 10 loops Warning(linengy): could not find 13 linearisation energies in s.c. loop 10 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -20.70463677 -5.251500000 for s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 128.0137926 Required : 294.0000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -25129.0485518 TEST_000.OUT : -32237.8779169 absolute difference : 7108.82936510 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.251290485518 Running test in directory test_006... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff868e6873 in ??? #1 0x7fff868e7f43 in ??? #2 0x7fff868e99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 8 Total number of threads (MPI x OpenMP) : 8 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 8 Number of MKL threads : 8 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.80006961 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.79778549 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.73540958 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.67918507 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.63646830 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.61683291 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.60946757 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.60947800 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.60950470 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.60950671 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 25.60950524 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 25.60950412 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 25.60950320 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 25.60950327 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 25.60950333 Required : 28.00000000 Info(elk): current task : 5 Info(genkmat): 3 of 16 k-points Info(genkmat): 1 of 16 k-points Info(genkmat): 15 of 16 k-points Info(genkmat): 13 of 16 k-points Info(genkmat): 11 of 16 k-points Info(genkmat): 5 of 16 k-points Info(genkmat): 9 of 16 k-points Info(genkmat): 7 of 16 k-points Info(genkmat): 6 of 16 k-points Info(genkmat): 4 of 16 k-points Info(genkmat): 14 of 16 k-points Info(genkmat): 16 of 16 k-points Info(genkmat): 10 of 16 k-points Info(genkmat): 8 of 16 k-points Info(genkmat): 12 of 16 k-points Info(genkmat): 2 of 16 k-points Info(hartfock): self-consistent loop number : 1 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.73665210 Required : 28.00000000 Info(hartfock): self-consistent loop number : 2 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.32795829 Required : 28.00000000 Info(hartfock): self-consistent loop number : 3 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -2.280905660 -2.000000000 for s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.24273254 Required : 28.00000000 Info(hartfock): self-consistent loop number : 4 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.48832186 Required : 28.00000000 Info(hartfock): self-consistent loop number : 5 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.29110813 Required : 28.00000000 Info(hartfock): self-consistent loop number : 6 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.33527086 Required : 28.00000000 Info(hartfock): self-consistent loop number : 7 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.40562530 Required : 28.00000000 Info(hartfock): self-consistent loop number : 8 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.42256374 Required : 28.00000000 Info(hartfock): self-consistent loop number : 9 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.39157313 Required : 28.00000000 Info(hartfock): self-consistent loop number : 10 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.24566807 Required : 28.00000000 Info(hartfock): self-consistent loop number : 11 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 25.26395136 Required : 28.00000000 Info(hartfock): self-consistent loop number : 12 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 25.23957447 Required : 28.00000000 Info(hartfock): self-consistent loop number : 13 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 25.40688912 Required : 28.00000000 Info(hartfock): self-consistent loop number : 14 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 25.20907467 Required : 28.00000000 Info(hartfock): self-consistent loop number : 15 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 25.40279170 Required : 28.00000000 Info(hartfock): self-consistent loop number : 16 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 25.42621220 Required : 28.00000000 Info(hartfock): self-consistent loop number : 17 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 25.26783359 Required : 28.00000000 Info(hartfock): self-consistent loop number : 18 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 25.44435981 Required : 28.00000000 Info(hartfock): self-consistent loop number : 19 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 25.23717397 Required : 28.00000000 Info(hartfock): self-consistent loop number : 20 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 25.16510385 Required : 28.00000000 Info(hartfock): self-consistent loop number : 21 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 25.15459525 Required : 28.00000000 Info(hartfock): self-consistent loop number : 22 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 25.20034938 Required : 28.00000000 Info(hartfock): self-consistent loop number : 23 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 25.26767605 Required : 28.00000000 Info(hartfock): self-consistent loop number : 24 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 25.34924232 Required : 28.00000000 Info(hartfock): self-consistent loop number : 25 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 25.21873128 Required : 28.00000000 Info(hartfock): self-consistent loop number : 26 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 25.26495855 Required : 28.00000000 Info(hartfock): self-consistent loop number : 27 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 25.25827548 Required : 28.00000000 Info(hartfock): self-consistent loop number : 28 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 25.31002710 Required : 28.00000000 Info(hartfock): self-consistent loop number : 29 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 25.29389166 Required : 28.00000000 Info(hartfock): self-consistent loop number : 30 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 25.21261711 Required : 28.00000000 Info(hartfock): self-consistent loop number : 31 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 25.29007927 Required : 28.00000000 Info(hartfock): self-consistent loop number : 32 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 25.34285594 Required : 28.00000000 Info(hartfock): self-consistent loop number : 33 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 25.24796938 Required : 28.00000000 Info(hartfock): self-consistent loop number : 34 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 25.33446822 Required : 28.00000000 Info(hartfock): self-consistent loop number : 35 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 25.28187062 Required : 28.00000000 Info(hartfock): self-consistent loop number : 36 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 25.36351314 Required : 28.00000000 Info(hartfock): self-consistent loop number : 37 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 25.36017941 Required : 28.00000000 Info(hartfock): self-consistent loop number : 38 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 25.19600815 Required : 28.00000000 Info(hartfock): self-consistent loop number : 39 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 25.46867266 Required : 28.00000000 Info(hartfock): self-consistent loop number : 40 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 25.08766880 Required : 28.00000000 Info(hartfock): self-consistent loop number : 41 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 25.28162378 Required : 28.00000000 Info(hartfock): self-consistent loop number : 42 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 25.44048098 Required : 28.00000000 Info(hartfock): self-consistent loop number : 43 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 25.22723547 Required : 28.00000000 Info(hartfock): self-consistent loop number : 44 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 25.25346668 Required : 28.00000000 Info(hartfock): self-consistent loop number : 45 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 25.23471257 Required : 28.00000000 Info(hartfock): self-consistent loop number : 46 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 25.40733197 Required : 28.00000000 Info(hartfock): self-consistent loop number : 47 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 25.19103341 Required : 28.00000000 Info(hartfock): self-consistent loop number : 48 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 25.28542052 Required : 28.00000000 Info(hartfock): self-consistent loop number : 49 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 25.24750716 Required : 28.00000000 Info(hartfock): self-consistent loop number : 50 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 25.23602504 Required : 28.00000000 Info(hartfock): self-consistent loop number : 51 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 25.21564603 Required : 28.00000000 Info(hartfock): self-consistent loop number : 52 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 25.28114365 Required : 28.00000000 Info(hartfock): self-consistent loop number : 53 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 25.38530526 Required : 28.00000000 Info(hartfock): self-consistent loop number : 54 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 25.21659145 Required : 28.00000000 Info(hartfock): self-consistent loop number : 55 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 25.26337272 Required : 28.00000000 Info(hartfock): self-consistent loop number : 56 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 25.30840711 Required : 28.00000000 Info(hartfock): self-consistent loop number : 57 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 25.23781673 Required : 28.00000000 Info(hartfock): self-consistent loop number : 58 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 25.24021732 Required : 28.00000000 Info(hartfock): self-consistent loop number : 59 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 25.37305033 Required : 28.00000000 Info(hartfock): self-consistent loop number : 60 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 25.24451993 Required : 28.00000000 Info(hartfock): self-consistent loop number : 61 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 25.27243810 Required : 28.00000000 Info(hartfock): self-consistent loop number : 62 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 25.44475708 Required : 28.00000000 Info(hartfock): self-consistent loop number : 63 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 25.25999497 Required : 28.00000000 Info(hartfock): self-consistent loop number : 64 Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 25.10498676 Required : 28.00000000 Info(hartfock): self-consistent loop number : 65 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 25.25028276 Required : 28.00000000 Info(hartfock): self-consistent loop number : 66 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 25.18919111 Required : 28.00000000 Info(hartfock): self-consistent loop number : 67 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 25.49078007 Required : 28.00000000 Info(hartfock): self-consistent loop number : 68 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 25.35779828 Required : 28.00000000 Info(hartfock): self-consistent loop number : 69 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 25.17325489 Required : 28.00000000 Info(hartfock): self-consistent loop number : 70 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 25.15943040 Required : 28.00000000 Info(hartfock): self-consistent loop number : 71 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 25.22388231 Required : 28.00000000 Info(hartfock): self-consistent loop number : 72 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 25.29790797 Required : 28.00000000 Info(hartfock): self-consistent loop number : 73 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 25.29698084 Required : 28.00000000 Info(hartfock): self-consistent loop number : 74 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 25.26152600 Required : 28.00000000 Info(hartfock): self-consistent loop number : 75 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 25.21877004 Required : 28.00000000 Info(hartfock): self-consistent loop number : 76 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 25.35146670 Required : 28.00000000 Info(hartfock): self-consistent loop number : 77 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 25.20030949 Required : 28.00000000 Info(hartfock): self-consistent loop number : 78 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 25.13803635 Required : 28.00000000 Info(hartfock): self-consistent loop number : 79 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 25.29627601 Required : 28.00000000 Info(hartfock): self-consistent loop number : 80 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 25.38577553 Required : 28.00000000 Info(hartfock): self-consistent loop number : 81 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 25.27768173 Required : 28.00000000 Info(hartfock): self-consistent loop number : 82 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 25.22490401 Required : 28.00000000 Info(hartfock): self-consistent loop number : 83 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 25.30515004 Required : 28.00000000 Info(hartfock): self-consistent loop number : 84 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 25.23612168 Required : 28.00000000 Info(hartfock): self-consistent loop number : 85 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 25.26658503 Required : 28.00000000 Info(hartfock): self-consistent loop number : 86 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 25.21101565 Required : 28.00000000 Info(hartfock): self-consistent loop number : 87 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 25.33024230 Required : 28.00000000 Info(hartfock): self-consistent loop number : 88 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 25.20890861 Required : 28.00000000 Info(hartfock): self-consistent loop number : 89 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 25.26607236 Required : 28.00000000 Info(hartfock): self-consistent loop number : 90 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 25.30830776 Required : 28.00000000 Info(hartfock): self-consistent loop number : 91 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 25.34997699 Required : 28.00000000 Info(hartfock): self-consistent loop number : 92 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 25.31490483 Required : 28.00000000 Info(hartfock): self-consistent loop number : 93 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 25.33029943 Required : 28.00000000 Info(hartfock): self-consistent loop number : 94 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 25.48151510 Required : 28.00000000 Info(hartfock): self-consistent loop number : 95 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 25.28693603 Required : 28.00000000 Info(hartfock): self-consistent loop number : 96 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 25.15634603 Required : 28.00000000 Info(hartfock): self-consistent loop number : 97 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 25.14411290 Required : 28.00000000 Info(hartfock): self-consistent loop number : 98 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 25.32956205 Required : 28.00000000 Info(hartfock): self-consistent loop number : 99 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 25.32598564 Required : 28.00000000 Info(hartfock): self-consistent loop number : 100 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 25.35030221 Required : 28.00000000 Info(hartfock): self-consistent loop number : 101 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 25.26152107 Required : 28.00000000 Info(hartfock): self-consistent loop number : 102 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 25.35783247 Required : 28.00000000 Info(hartfock): self-consistent loop number : 103 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 25.45335015 Required : 28.00000000 Info(hartfock): self-consistent loop number : 104 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 25.21724849 Required : 28.00000000 Info(hartfock): self-consistent loop number : 105 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 25.06943256 Required : 28.00000000 Info(hartfock): self-consistent loop number : 106 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 25.20197107 Required : 28.00000000 Info(hartfock): self-consistent loop number : 107 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 25.24615306 Required : 28.00000000 Info(hartfock): self-consistent loop number : 108 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 25.31145913 Required : 28.00000000 Info(hartfock): self-consistent loop number : 109 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 25.29627833 Required : 28.00000000 Info(hartfock): self-consistent loop number : 110 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 25.17857956 Required : 28.00000000 Info(hartfock): self-consistent loop number : 111 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 25.35354284 Required : 28.00000000 Info(hartfock): self-consistent loop number : 112 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 25.28179421 Required : 28.00000000 Info(hartfock): self-consistent loop number : 113 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 25.33729492 Required : 28.00000000 Info(hartfock): self-consistent loop number : 114 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 25.26476813 Required : 28.00000000 Info(hartfock): self-consistent loop number : 115 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 25.23969184 Required : 28.00000000 Info(hartfock): self-consistent loop number : 116 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 25.28299222 Required : 28.00000000 Info(hartfock): self-consistent loop number : 117 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 25.29560430 Required : 28.00000000 Info(hartfock): self-consistent loop number : 118 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 25.35576639 Required : 28.00000000 Info(hartfock): self-consistent loop number : 119 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 25.27703379 Required : 28.00000000 Info(hartfock): self-consistent loop number : 120 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 25.18990670 Required : 28.00000000 Info(hartfock): self-consistent loop number : 121 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 25.19437202 Required : 28.00000000 Info(hartfock): self-consistent loop number : 122 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 25.36529372 Required : 28.00000000 Info(hartfock): self-consistent loop number : 123 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 25.29845537 Required : 28.00000000 Info(hartfock): self-consistent loop number : 124 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 25.36900174 Required : 28.00000000 Info(hartfock): self-consistent loop number : 125 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 25.29301110 Required : 28.00000000 Info(hartfock): self-consistent loop number : 126 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 25.18113259 Required : 28.00000000 Info(hartfock): self-consistent loop number : 127 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 25.33557105 Required : 28.00000000 Info(hartfock): self-consistent loop number : 128 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 25.30656026 Required : 28.00000000 Info(hartfock): self-consistent loop number : 129 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 25.29624392 Required : 28.00000000 Info(hartfock): self-consistent loop number : 130 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 25.24474476 Required : 28.00000000 Info(hartfock): self-consistent loop number : 131 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 25.35140515 Required : 28.00000000 Info(hartfock): self-consistent loop number : 132 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 25.18506683 Required : 28.00000000 Info(hartfock): self-consistent loop number : 133 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 25.41922679 Required : 28.00000000 Info(hartfock): self-consistent loop number : 134 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 25.26852112 Required : 28.00000000 Info(hartfock): self-consistent loop number : 135 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 25.46493230 Required : 28.00000000 Info(hartfock): self-consistent loop number : 136 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 25.32250160 Required : 28.00000000 Info(hartfock): self-consistent loop number : 137 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 25.30015424 Required : 28.00000000 Info(hartfock): self-consistent loop number : 138 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 25.31473160 Required : 28.00000000 Info(hartfock): self-consistent loop number : 139 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 25.31252954 Required : 28.00000000 Info(hartfock): self-consistent loop number : 140 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 25.27322194 Required : 28.00000000 Info(hartfock): self-consistent loop number : 141 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 25.31000687 Required : 28.00000000 Info(hartfock): self-consistent loop number : 142 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 25.31730849 Required : 28.00000000 Info(hartfock): self-consistent loop number : 143 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 25.30243649 Required : 28.00000000 Info(hartfock): self-consistent loop number : 144 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 25.27848603 Required : 28.00000000 Info(hartfock): self-consistent loop number : 145 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 25.35392072 Required : 28.00000000 Info(hartfock): self-consistent loop number : 146 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 25.25455015 Required : 28.00000000 Info(hartfock): self-consistent loop number : 147 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 25.38569615 Required : 28.00000000 Info(hartfock): self-consistent loop number : 148 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 25.23518901 Required : 28.00000000 Info(hartfock): self-consistent loop number : 149 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 25.25935425 Required : 28.00000000 Info(hartfock): self-consistent loop number : 150 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 25.35089717 Required : 28.00000000 Info(hartfock): self-consistent loop number : 151 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 25.24049708 Required : 28.00000000 Info(hartfock): self-consistent loop number : 152 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 25.39175924 Required : 28.00000000 Info(hartfock): self-consistent loop number : 153 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 25.24339441 Required : 28.00000000 Info(hartfock): self-consistent loop number : 154 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 25.28170551 Required : 28.00000000 Info(hartfock): self-consistent loop number : 155 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 25.17363932 Required : 28.00000000 Info(hartfock): self-consistent loop number : 156 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 25.30270930 Required : 28.00000000 Info(hartfock): self-consistent loop number : 157 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 25.18440472 Required : 28.00000000 Info(hartfock): self-consistent loop number : 158 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 25.15750920 Required : 28.00000000 Info(hartfock): self-consistent loop number : 159 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 25.37049122 Required : 28.00000000 Info(hartfock): self-consistent loop number : 160 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 25.26774045 Required : 28.00000000 Info(hartfock): self-consistent loop number : 161 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 25.20695256 Required : 28.00000000 Info(hartfock): self-consistent loop number : 162 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 25.24189884 Required : 28.00000000 Info(hartfock): self-consistent loop number : 163 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 25.25371353 Required : 28.00000000 Info(hartfock): self-consistent loop number : 164 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 25.29640646 Required : 28.00000000 Info(hartfock): self-consistent loop number : 165 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 25.21946560 Required : 28.00000000 Info(hartfock): self-consistent loop number : 166 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 25.27209701 Required : 28.00000000 Info(hartfock): self-consistent loop number : 167 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 25.26158987 Required : 28.00000000 Info(hartfock): self-consistent loop number : 168 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 25.25085887 Required : 28.00000000 Info(hartfock): self-consistent loop number : 169 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 25.23206526 Required : 28.00000000 Info(hartfock): self-consistent loop number : 170 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 25.26617922 Required : 28.00000000 Info(hartfock): self-consistent loop number : 171 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 25.29695685 Required : 28.00000000 Info(hartfock): self-consistent loop number : 172 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 25.26081958 Required : 28.00000000 Info(hartfock): self-consistent loop number : 173 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 25.28240070 Required : 28.00000000 Info(hartfock): self-consistent loop number : 174 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 25.36239786 Required : 28.00000000 Info(hartfock): self-consistent loop number : 175 Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 25.25059190 Required : 28.00000000 Info(hartfock): self-consistent loop number : 176 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 25.18407923 Required : 28.00000000 Info(hartfock): self-consistent loop number : 177 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 25.29185303 Required : 28.00000000 Info(hartfock): self-consistent loop number : 178 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 25.15910615 Required : 28.00000000 Info(hartfock): self-consistent loop number : 179 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 25.28873727 Required : 28.00000000 Info(hartfock): self-consistent loop number : 180 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 25.34058775 Required : 28.00000000 Info(hartfock): self-consistent loop number : 181 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 25.29887634 Required : 28.00000000 Info(hartfock): self-consistent loop number : 182 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 25.25141225 Required : 28.00000000 Info(hartfock): self-consistent loop number : 183 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 25.35159603 Required : 28.00000000 Info(hartfock): self-consistent loop number : 184 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 25.27991771 Required : 28.00000000 Info(hartfock): self-consistent loop number : 185 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 25.16897866 Required : 28.00000000 Info(hartfock): self-consistent loop number : 186 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 25.25679899 Required : 28.00000000 Info(hartfock): self-consistent loop number : 187 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 25.30401534 Required : 28.00000000 Info(hartfock): self-consistent loop number : 188 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 25.43969700 Required : 28.00000000 Info(hartfock): self-consistent loop number : 189 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 25.30647409 Required : 28.00000000 Info(hartfock): self-consistent loop number : 190 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 25.39581684 Required : 28.00000000 Info(hartfock): self-consistent loop number : 191 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 25.24177600 Required : 28.00000000 Info(hartfock): self-consistent loop number : 192 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 25.24504511 Required : 28.00000000 Info(hartfock): self-consistent loop number : 193 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 25.20952682 Required : 28.00000000 Info(hartfock): self-consistent loop number : 194 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 25.18091226 Required : 28.00000000 Info(hartfock): self-consistent loop number : 195 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 25.21898504 Required : 28.00000000 Info(hartfock): self-consistent loop number : 196 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 12 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 25.18292714 Required : 28.00000000 Info(hartfock): self-consistent loop number : 197 Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 25.11518486 Required : 28.00000000 Info(hartfock): self-consistent loop number : 198 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 25.31495950 Required : 28.00000000 Info(hartfock): self-consistent loop number : 199 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 8 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 6 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 25.23972489 Required : 28.00000000 Info(hartfock): self-consistent loop number : 200 Info(eveqnhf): 3 of 16 k-points Info(eveqnhf): 1 of 16 k-points Info(eveqnhf): 5 of 16 k-points Info(eveqnhf): 9 of 16 k-points Info(eveqnhf): 11 of 16 k-points Info(eveqnhf): 13 of 16 k-points Info(eveqnhf): 7 of 16 k-points Info(eveqnhf): 15 of 16 k-points Info(eveqnhf): 4 of 16 k-points Info(eveqnhf): 16 of 16 k-points Info(eveqnhf): 2 of 16 k-points Info(eveqnhf): 6 of 16 k-points Info(eveqnhf): 10 of 16 k-points Info(eveqnhf): 14 of 16 k-points Info(eveqnhf): 12 of 16 k-points Info(eveqnhf): 8 of 16 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 25.26718432 Required : 28.00000000 Info(exxengy): 3 of 16 k-points Info(exxengy): 1 of 16 k-points Info(exxengy): 11 of 16 k-points Info(exxengy): 5 of 16 k-points Info(exxengy): 7 of 16 k-points Info(exxengy): 9 of 16 k-points Info(exxengy): 13 of 16 k-points Info(exxengy): 15 of 16 k-points Info(exxengy): 4 of 16 k-points Info(exxengy): 2 of 16 k-points Info(exxengy): 10 of 16 k-points Info(exxengy): 8 of 16 k-points Info(exxengy): 14 of 16 k-points Info(exxengy): 6 of 16 k-points Info(exxengy): 12 of 16 k-points Info(exxengy): 16 of 16 k-points Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -580.163931813 TEST_000.OUT : -578.132106934 absolute difference : 2.03182487900 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.580163931813E-02 cd tests; ./test-mpi.sh Running test in directory test_001... real 139m50.022s user 246m35.517s sys 4m49.433s + cp -rp tests.orig tests + sed -i 's#mpirun -n 4 ../../src/elk#mpiexec -np 1 ../../elk_mpich#g' tests/test-mpi.sh + sed -i '/Failed/ a cat test.log' tests/test-mpi.sh + /usr/bin/make test-mpi + tee test-mpi.1_mpich.log ERROR STOP Error termination. Backtrace: #0 0x7fff897f6873 in ??? #1 0x7fff897f7f43 in ??? #2 0x7fff897f99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 3 (Cu) from 2.4000 to 1.9694 Info(checkmt): reduced muffin-tin radius of species 4 (O) from 1.8000 to 1.4770 Info(findsymcrys): atomic basis shift (lattice) : -0.5000000000 -0.5000000000 -0.5000000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 330.4323403 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 342.5645270 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 336.4868212 Required : 294.0000000 Warning(gndstate): failed to reach self-consistency after 4 loops Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 372.8017241 Required : 294.0000000 Info(elk): current task : 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 388.9004369 Required : 294.0000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 2467.014810 Required : 294.0000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 92218.56150 Required : 294.0000000 Warning(gndstate): failed to reach self-consistency after 4 loops Warning(linengy): could not find 12 linearisation energies in s.c. loop 4 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -104.8019794 -5.251500000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 75.00586275 Required : 294.0000000 Info(elk): current task : 115 Info(writeefg): electric field gradient written to EFG.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -25088.8810466 TEST_000.OUT : -17874.2873010 absolute difference : 7214.59374560 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.250888810466 Running test in directory test_002... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff9c356873 in ??? #1 0x7fff9c357f43 in ??? #2 0x7fff9c3599eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.3202 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 19.12034847 Required : 26.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 18.76537981 Required : 26.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 19.39854970 Required : 26.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 19.61487856 Required : 26.00000000 Warning(gndstate): failed to reach self-consistency after 5 loops Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 19.31591216 Required : 26.00000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1270.55032940 TEST_000.OUT : -1177.46284682 absolute difference : 93.0874825800 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.127055032940E-01 Running test in directory test_003... ERROR STOP Error termination. Backtrace: #0 0x7fff869c6873 in ??? #1 0x7fff869c7f43 in ??? #2 0x7fff869c99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1436 Info(findsymcrys): atomic basis shift (lattice) : 0.3650000000 0.3650000000 0.3650000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.87593671 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.87428762 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.79157153 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.73858845 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.71846150 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 25.71292417 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.71158154 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.71182778 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.71193924 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 10 loops Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 25.71190932 Required : 28.00000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -580.223475286 TEST_000.OUT : -580.290032091 absolute difference : 0.665568049999E-01 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.580223475286E-02 Running test in directory test_004... ERROR STOP Error termination. Backtrace: #0 0x7fff9f1b6873 in ??? #1 0x7fff9f1b7f43 in ??? #2 0x7fff9f1b99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Li) from 1.8000 to 1.7782 Info(checkmt): reduced muffin-tin radius of species 2 (F) from 2.0000 to 1.9758 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 9.121207069 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 9.129808960 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 9.226985205 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 9.313622311 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 9.432643146 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 9.525910356 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 9.570569261 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 9.568221698 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 9.568696411 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 9.568735060 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 9.568817699 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 9.568827141 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 9.568827723 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 9.568827086 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 9.568826962 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 9.568826831 Required : 12.00000000 Info(elk): current task : 120 Info(genpmat): 1 of 8 k-points Info(genpmat): 5 of 8 k-points Info(genpmat): 2 of 8 k-points Info(genpmat): 3 of 8 k-points Info(genpmat): 4 of 8 k-points Info(genpmat): 6 of 8 k-points Info(genpmat): 7 of 8 k-points Info(genpmat): 8 of 8 k-points Info(writepmat): momentum matrix elements written to file PMAT.OUT Info(elk): current task : 121 Info(dielectric): dielectric tensor written to EPSILON_ij.OUT optical conductivity written to SIGMA_ij.OUT for components i = 1, j = 1 Info(elk): current task : 180 Info(epsinv): 1 of 8 q-points Info(epsinv): 2 of 8 q-points Info(epsinv): 3 of 8 q-points Info(epsinv): 4 of 8 q-points Info(epsinv): 5 of 8 q-points Info(epsinv): 6 of 8 q-points Info(epsinv): 7 of 8 q-points Info(epsinv): 8 of 8 q-points Info(writeepsinv): inverse RPA dielectric function, eps^(-1)(G,G',q,w), written to EPSINV.OUT Info(elk): current task : 185 Info(writehmlbse): setting up BSE Hamiltonian matrix Info(hmlxbse): 1 of 64 k-points Info(hmlxbse): 33 of 64 k-points Info(hmlxbse): 2 of 64 k-points Info(hmlxbse): 34 of 64 k-points Info(hmlxbse): 3 of 64 k-points Info(hmlxbse): 35 of 64 k-points Info(hmlxbse): 4 of 64 k-points Info(hmlxbse): 36 of 64 k-points Info(hmlxbse): 5 of 64 k-points Info(hmlxbse): 37 of 64 k-points Info(hmlxbse): 6 of 64 k-points Info(hmlxbse): 38 of 64 k-points Info(hmlxbse): 7 of 64 k-points Info(hmlxbse): 39 of 64 k-points Info(hmlxbse): 8 of 64 k-points Info(hmlxbse): 40 of 64 k-points Info(hmlxbse): 9 of 64 k-points Info(hmlxbse): 41 of 64 k-points Info(hmlxbse): 10 of 64 k-points Info(hmlxbse): 42 of 64 k-points Info(hmlxbse): 11 of 64 k-points Info(hmlxbse): 43 of 64 k-points Info(hmlxbse): 12 of 64 k-points Info(hmlxbse): 44 of 64 k-points Info(hmlxbse): 13 of 64 k-points Info(hmlxbse): 45 of 64 k-points Info(hmlxbse): 14 of 64 k-points Info(hmlxbse): 46 of 64 k-points Info(hmlxbse): 15 of 64 k-points Info(hmlxbse): 47 of 64 k-points Info(hmlxbse): 16 of 64 k-points Info(hmlxbse): 48 of 64 k-points Info(hmlxbse): 17 of 64 k-points Info(hmlxbse): 49 of 64 k-points Info(hmlxbse): 18 of 64 k-points Info(hmlxbse): 50 of 64 k-points Info(hmlxbse): 19 of 64 k-points Info(hmlxbse): 51 of 64 k-points Info(hmlxbse): 20 of 64 k-points Info(hmlxbse): 52 of 64 k-points Info(hmlxbse): 21 of 64 k-points Info(hmlxbse): 53 of 64 k-points Info(hmlxbse): 22 of 64 k-points Info(hmlxbse): 54 of 64 k-points Info(hmlxbse): 23 of 64 k-points Info(hmlxbse): 55 of 64 k-points Info(hmlxbse): 24 of 64 k-points Info(hmlxbse): 56 of 64 k-points Info(hmlxbse): 25 of 64 k-points Info(hmlxbse): 57 of 64 k-points Info(hmlxbse): 26 of 64 k-points Info(hmlxbse): 58 of 64 k-points Info(hmlxbse): 27 of 64 k-points Info(hmlxbse): 59 of 64 k-points Info(hmlxbse): 28 of 64 k-points Info(hmlxbse): 60 of 64 k-points Info(hmlxbse): 29 of 64 k-points Info(hmlxbse): 61 of 64 k-points Info(hmlxbse): 30 of 64 k-points Info(hmlxbse): 62 of 64 k-points Info(hmlxbse): 31 of 64 k-points Info(hmlxbse): 63 of 64 k-points Info(hmlxbse): 32 of 64 k-points Info(hmlxbse): 64 of 64 k-points Info(hmldbse): 33 of 64 k-points Info(hmldbse): 1 of 64 k-points Info(hmldbse): 2 of 64 k-points Info(hmldbse): 34 of 64 k-points Info(hmldbse): 3 of 64 k-points Info(hmldbse): 35 of 64 k-points Info(hmldbse): 4 of 64 k-points Info(hmldbse): 5 of 64 k-points Info(hmldbse): 36 of 64 k-points Info(hmldbse): 6 of 64 k-points Info(hmldbse): 7 of 64 k-points Info(hmldbse): 37 of 64 k-points Info(hmldbse): 38 of 64 k-points Info(hmldbse): 8 of 64 k-points Info(hmldbse): 39 of 64 k-points Info(hmldbse): 9 of 64 k-points Info(hmldbse): 40 of 64 k-points Info(hmldbse): 41 of 64 k-points Info(hmldbse): 10 of 64 k-points Info(hmldbse): 11 of 64 k-points Info(hmldbse): 42 of 64 k-points Info(hmldbse): 12 of 64 k-points Info(hmldbse): 43 of 64 k-points Info(hmldbse): 13 of 64 k-points Info(hmldbse): 44 of 64 k-points Info(hmldbse): 14 of 64 k-points Info(hmldbse): 15 of 64 k-points Info(hmldbse): 45 of 64 k-points Info(hmldbse): 46 of 64 k-points Info(hmldbse): 16 of 64 k-points Info(hmldbse): 47 of 64 k-points Info(hmldbse): 17 of 64 k-points Info(hmldbse): 48 of 64 k-points Info(hmldbse): 49 of 64 k-points Info(hmldbse): 18 of 64 k-points Info(hmldbse): 50 of 64 k-points Info(hmldbse): 19 of 64 k-points Info(hmldbse): 51 of 64 k-points Info(hmldbse): 20 of 64 k-points Info(hmldbse): 21 of 64 k-points Info(hmldbse): 52 of 64 k-points Info(hmldbse): 22 of 64 k-points Info(hmldbse): 53 of 64 k-points Info(hmldbse): 23 of 64 k-points Info(hmldbse): 54 of 64 k-points Info(hmldbse): 24 of 64 k-points Info(hmldbse): 55 of 64 k-points Info(hmldbse): 25 of 64 k-points Info(hmldbse): 56 of 64 k-points Info(hmldbse): 26 of 64 k-points Info(hmldbse): 57 of 64 k-points Info(hmldbse): 27 of 64 k-points Info(hmldbse): 58 of 64 k-points Info(hmldbse): 59 of 64 k-points Info(hmldbse): 28 of 64 k-points Info(hmldbse): 60 of 64 k-points Info(hmldbse): 29 of 64 k-points Info(hmldbse): 61 of 64 k-points Info(hmldbse): 62 of 64 k-points Info(hmldbse): 30 of 64 k-points Info(hmldbse): 31 of 64 k-points Info(hmldbse): 63 of 64 k-points Info(hmldbse): 64 of 64 k-points Info(hmldbse): 32 of 64 k-points Info(writehmlbse): BSE Hamiltonian matrix written to HMLBSE.OUT Info(elk): current task : 186 Info(writeevbse): diagonalising the BSE Hamiltonian matrix Info(writeevbse): BSE eigenvectors and eigenvalues written to EVBSE.OUT BSE eigenvalues written to EIGVAL_BSE.OUT Info(elk): current task : 187 Info(dielectric_bse): dielectric tensor written to EPSILON_BSE_ij.OUT for components i = 1, j = 1 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -106.907708837 TEST_000.OUT : -107.276177256 absolute difference : 0.368468419000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.106907708837E-02 Running test in directory test_005... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.3615 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 72 The leading minor of the overlap matrix of order 29 is not positive definite Order of overlap matrix : 43 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 78 The leading minor of the overlap matrix of order 32 is not positive definite Order of overlap matrix : 46 Running test in directory test_006... Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.4000 to 2.2888 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.4000 to 2.2888 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 215 The leading minor of the overlap matrix of order 94 is not positive definite Order of overlap matrix : 121 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 215 The leading minor of the overlap matrix of order 94 is not positive definite Running test in directory test_007... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff9dc26873 in ??? #1 0x7fff9dc27f43 in ??? #2 0x7fff9dc299eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.675350338 -5.434400000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 27.02068224 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 26.52307399 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 25.56382962 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 26.16382980 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 25.65344329 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.611545640 -5.434400000 for s.c. loop 6 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 26.13581589 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.652768890 -5.434400000 for s.c. loop 7 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 25.99496357 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.012254561 -5.434400000 for s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 25.89943721 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.509554237 -5.434400000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 25.95363135 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.233259905 -5.434400000 for s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 26.09182266 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 25.07427928 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.570975256 -5.434400000 for s.c. loop 12 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 25.95799765 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 26.06950114 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.544800140 -5.434400000 for s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 25.99316301 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.609312906 -5.434400000 for s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 25.65501549 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.136045418 -5.434400000 for s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 25.87379969 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 26.18093431 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 25.92516052 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.774529620 -5.434400000 for s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 25.34410137 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.979355341 -5.434400000 for s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 25.49720055 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 24.90449275 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.888924447 -5.434400000 for s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 24.81008891 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 26.72837700 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 26.49022399 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.531871250 -5.434400000 for s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 25.71382137 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.046899313 -5.434400000 for s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 25.36323511 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.737409157 -5.434400000 for s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 26.13704136 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.572193130 -5.434400000 for s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 25.44433573 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 25.50713513 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 25.81953763 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 25.77783843 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.737433518 -5.434400000 for s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 26.06637661 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.573935348 -5.434400000 for s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 26.28883473 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 25.98466779 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.898260840 -5.434400000 for s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 25.70734344 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.748877965 -5.434400000 for s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 25.76412079 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 26.08231685 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 26.21737077 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.608930761 -5.434400000 for s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 26.43736444 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 26.19290975 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 26.17346355 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 25.95956858 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.131301033 -5.434400000 for s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 26.19477044 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.564574729 -5.434400000 for s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 26.37045996 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 26.34870870 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.063064295 -5.434400000 for s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 26.39452554 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.982865260 -5.434400000 for s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 26.21179492 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.560716804 -5.434400000 for s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 25.80416668 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.347373952 -5.434400000 for s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 26.14698767 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.809327101 -5.434400000 for s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 26.06770651 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.380407035 -5.434400000 for s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 26.23582223 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.076975393 -5.434400000 for s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 25.77127022 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.330850251 -5.434400000 for s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 26.17618784 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.507628937 -5.434400000 for s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 26.46644154 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.574084732 -5.434400000 for s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 26.17461123 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.180036094 -5.434400000 for s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 26.00777244 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 25.51922085 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.785396960 -5.434400000 for s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 25.18723134 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.530850819 -5.434400000 for s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 25.46232224 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.471806637 -5.434400000 for s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 25.80923147 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.864261291 -5.434400000 for s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 25.17503117 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.272574814 -5.434400000 for s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 24.96047567 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 25.87631542 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.551985252 -5.434400000 for s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 25.62502387 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 25.72544461 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.722322136 -5.434400000 for s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 25.54042764 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.881569214 -5.434400000 for s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 25.73709521 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 25.15013633 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.212809084 -5.434400000 for s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 25.66848657 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.725241561 -5.434400000 for s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 25.93215248 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.710618059 -5.434400000 for s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 26.19307616 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.475398595 -5.434400000 for s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 25.50994340 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.171255202 -5.434400000 for s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 25.79743059 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.559575348 -5.434400000 for s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 25.86931661 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 25.24111700 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 25.86151794 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 25.58222510 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.849975561 -5.434400000 for s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 25.47244093 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.756638547 -5.434400000 for s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 24.98961376 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.545769221 -5.434400000 for s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 25.88065068 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.832598840 -5.434400000 for s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 25.47117824 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.449784792 -5.434400000 for s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 25.34267028 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.749629492 -5.434400000 for s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 25.30483554 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.970786140 -5.434400000 for s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 25.74399332 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.783551142 -5.434400000 for s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 26.29346830 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.601900757 -5.434400000 for s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 25.90258729 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.472194454 -5.434400000 for s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 24.99501246 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 24.72016071 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.528930972 -5.434400000 for s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 25.55609843 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.101411128 -5.434400000 for s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 25.58188167 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.451210922 -5.434400000 for s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 26.00241941 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.538130038 -5.434400000 for s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 25.74438534 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.805285020 -5.434400000 for s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 25.45821926 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -12.17860860 -5.434400000 for s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 25.34215846 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 25.67980774 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.265562497 -5.434400000 for s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 26.08975852 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.743407256 -5.434400000 for s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 25.53455104 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 26.08829609 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.170217432 -5.434400000 for s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 25.91192226 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 26.06123932 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 25.67625424 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.573112814 -5.434400000 for s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 25.62438248 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 25.21060817 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 25.36230004 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.229477707 -5.434400000 for s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 26.17435243 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.116995493 -5.434400000 for s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 26.17409144 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 25.33335055 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 25.48965667 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.016091408 -5.434400000 for s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 25.23421373 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 25.20821007 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.577437558 -5.434400000 for s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 26.02658070 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 25.56992036 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.613973881 -5.434400000 for s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 25.46948443 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 25.49041695 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.496988447 -5.434400000 for s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 25.51987063 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 25.76003752 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.563343052 -5.434400000 for s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 25.91571460 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 25.45203055 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.471844184 -5.434400000 for s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 25.82501133 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.535174562 -5.434400000 for s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 25.78849841 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.004520410 -5.434400000 for s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 26.06730029 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.368500133 -5.434400000 for s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 25.87849680 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 25.76152820 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 26.25215515 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 26.81741957 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.534337874 -5.434400000 for s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 25.99708525 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -10.04359841 -5.434400000 for s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 26.47610347 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.527888178 -5.434400000 for s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 25.80298561 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 25.90957512 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 25.12512298 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 25.59861752 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.031886854 -5.434400000 for s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 25.51934916 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.153139493 -5.434400000 for s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 25.06488509 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.434775041 -5.434400000 for s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 25.23269512 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.556028173 -5.434400000 for s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 25.78099315 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.511585737 -5.434400000 for s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 25.36862092 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 25.86685168 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.110716860 -5.434400000 for s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 25.03882634 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 26.25511380 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.464137660 -5.434400000 for s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 25.71549700 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.527475499 -5.434400000 for s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 25.93143935 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.985160034 -5.434400000 for s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 25.94343606 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.725784435 -5.434400000 for s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 25.54001672 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 25.27290722 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.282655362 -5.434400000 for s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 25.85726189 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.184883486 -5.434400000 for s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 25.71323190 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.530467040 -5.434400000 for s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 25.93059153 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 26.23602420 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 25.73733484 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.255692395 -5.434400000 for s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 26.14436732 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.804953171 -5.434400000 for s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 26.11635350 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.312734624 -5.434400000 for s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 25.77042066 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.632316596 -5.434400000 for s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 25.44880140 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.722696084 -5.434400000 for s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 26.24568753 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.842443708 -5.434400000 for s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 25.79496651 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 24.29531605 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.634001459 -5.434400000 for s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 24.97844122 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 25.69826313 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.185287506 -5.434400000 for s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 25.82749811 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 24.91623336 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.522233530 -5.434400000 for s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 26.49903472 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.611367598 -5.434400000 for s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 25.69052665 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 25.62304614 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 26.05743573 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.230446322 -5.434400000 for s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 25.67386517 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 25.29936965 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -9.565037968 -5.434400000 for s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 25.30395811 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 25.27207556 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.524304512 -5.434400000 for s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 26.52043236 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.856552679 -5.434400000 for s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 25.76725041 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.579764041 -5.434400000 for s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 26.04960964 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 25.99509588 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.761352064 -5.434400000 for s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 26.07619852 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.835413111 -5.434400000 for s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 25.96744481 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.976849884 -5.434400000 for s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 25.21152787 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.085354678 -5.434400000 for s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 26.17310582 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.041349292 -5.434400000 for s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 26.05950947 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.185146242 -5.434400000 for s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 25.85252697 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.166940056 -5.434400000 for s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 26.13940145 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.807998262 -5.434400000 for s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 25.97205519 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.768551277 -5.434400000 for s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 24.85708435 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.578639020 -5.434400000 for s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 25.46141965 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.139008013 -5.434400000 for s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 25.58789682 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.976182105 -5.434400000 for s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 25.26275478 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.743268490 -5.434400000 for s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 25.29194160 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.237989894 -5.434400000 for s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 25.21246383 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 25.11975465 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.651892915 -5.434400000 for s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 26.03004970 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.513690383 -5.434400000 for s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 25.91791005 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 25.74981945 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 26.06680084 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 25.46547471 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -9.327237371 -5.434400000 for s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 26.33071646 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 26.24541449 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.438122222 -5.434400000 for s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 26.16436559 Required : 39.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 25.68376195 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.382609458 -5.434400000 for s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 26.04129144 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.900648636 -5.434400000 for s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 26.01040603 Required : 39.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.683784279 -5.434400000 for s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 25.47512746 Required : 39.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.764865028 -5.434400000 for s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 25.66360340 Required : 39.00000000 Info(elk): current task : 15 Info(writelsj): muffin-tin L, S and J expectation values written to LSJ.OUT Info(elk): current task : 16 Info(writelsj): muffin-tin L, S and J expectation values for each k-point and state in kstlist written to LSJ_KST.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1515.75083630 TEST_000.OUT : -1530.50217285 absolute difference : 14.7513365500 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.151575083630E-01 Running test in directory test_008... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff9f6a6873 in ??? #1 0x7fff9f6a7f43 in ??? #2 0x7fff9f6a99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 37.79254722 Required : 52.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 34.62206394 Required : 52.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 34.29675939 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.682272323 -5.434400000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 34.71596222 Required : 52.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 34.85478491 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.517510894 -5.434400000 for s.c. loop 6 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 34.99910363 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.597469983 -5.434400000 for s.c. loop 7 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 33.54120598 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 39.56301539 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 9 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -39.55229322 -5.434400000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 96.24068037 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 40.78416471 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 11 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -39.02649033 -5.434400000 for s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 43.55881435 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 12 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 38.00741077 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 13 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -21.23158418 -5.434400000 for s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 63.60164484 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 37.01074066 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 38.98638457 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 16 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -546.0655802 -5.434400000 for s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 787.7812118 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 50.24296019 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 50.01426535 Required : 52.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 49.20967773 Required : 52.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 41.31546970 Required : 52.00000000 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 36.87044039 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.277327887 -5.434400000 for s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 33.48067683 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.089208660 -5.434400000 for s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 34.11216899 Required : 52.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -11.91121720 -5.434400000 for s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 33.43741098 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 40.37343220 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 26 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -14.68715638 -5.434400000 for s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 45.02128465 Required : 52.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 27 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.451351391 -5.434400000 for s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 37.86450406 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 33.47650353 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 33.13881461 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 32.75481046 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 33.32864578 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 33.97079815 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 33.44590956 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 33.73449464 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 33.46766426 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 33.18005410 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 33.46713030 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 33.43751727 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 33.50050160 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 33.30901031 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 33.86282068 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 33.17071896 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 33.61250682 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 33.84582062 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 33.86086152 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 33.41929279 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 33.28106739 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 33.50226656 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 33.55211772 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 33.92211514 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 33.01273803 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 33.27426984 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 33.71613270 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 33.50958889 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 33.42094673 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 33.48571652 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 33.41450120 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 33.43046661 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 33.48601296 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 33.81655482 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 33.80463756 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 33.69176821 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 33.64590604 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 33.70542271 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 33.80718427 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 33.17142584 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 33.19023653 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 33.25744288 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 33.30643322 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 33.14599216 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 33.40823239 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 33.42985128 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 33.36410817 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 33.61709650 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 33.46276386 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 33.65320398 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 33.26649319 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 33.47137685 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 33.13587786 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 33.59957377 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 33.61250839 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 33.72631280 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 33.31898063 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 33.49970848 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 33.40385761 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 33.80608008 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 33.58740895 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 33.48836554 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 33.66882738 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 33.15122437 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 34.01547978 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 33.54077347 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 33.44468655 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 33.48146171 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 33.68727683 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 33.64559828 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 33.79764886 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 33.77963875 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 33.41107433 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 33.20773608 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 33.15038361 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 33.49220259 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 33.35743326 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 32.92579213 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 33.41289626 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 33.11117831 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 33.60651461 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 33.67366401 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 33.34416006 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 33.34802113 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 33.33545226 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 33.39959750 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 33.14263508 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 32.97545267 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 33.48988069 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 33.38225645 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 33.56656196 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 33.46448387 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 33.57048985 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 33.31897297 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 33.47474364 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 33.43036079 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 33.59797708 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 33.72059899 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 33.06093256 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 33.57861701 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 33.45556585 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 33.63934766 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 33.93393457 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 33.45827296 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 33.45990971 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 33.23501367 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 33.52485773 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 33.59775198 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 33.40134938 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 33.15735964 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 33.96835238 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 33.09619771 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 33.58654450 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 33.47062308 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 33.45233586 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 33.53955216 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 33.06927356 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 33.52681522 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 33.44292051 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 33.49295212 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 33.24894513 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 33.71583137 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 33.38215272 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 33.67171673 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 33.57163020 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 33.84271558 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 33.83868331 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 33.49781765 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 33.61938752 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 33.64471051 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 33.58337332 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 33.41016113 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 33.41433842 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 33.60739117 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 33.56090680 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 33.67558966 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 33.45266040 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 33.31717969 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 33.87334643 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 33.51256778 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 33.24480765 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 33.61940365 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 33.55927127 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 33.37926905 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 33.14675662 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 33.42208536 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 33.37920612 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 33.32783769 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 33.13888574 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 33.23472718 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 33.59162335 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 33.23897008 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 33.37057506 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 32.92382493 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 33.40629038 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 33.56684460 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 33.54893565 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 33.64107281 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 33.68887646 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 33.29744928 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 33.62892417 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 33.19744541 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 33.56254624 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 33.61714593 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 33.34493362 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 33.26202680 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 33.36602342 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 33.45682668 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 33.34392748 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 33.42748715 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 33.18804257 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 33.32361326 Required : 52.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 33.28658406 Required : 52.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 33.32569479 Required : 52.00000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -2540.92552965 TEST_000.OUT : -2442.39674640 absolute difference : 98.5287832500 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.254092552965E-01 Running test in directory test_009... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (B) from 1.8000 to 1.6129 Info(checkmt): reduced muffin-tin radius of species 2 (N+) from 1.4500 to 1.2993 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 201 The leading minor of the overlap matrix of order 94 is not positive definite Order of overlap matrix : 107 Running test in directory test_010... ERROR STOP Error termination. Backtrace: #0 0x7fff95526873 in ??? #1 0x7fff95527f43 in ??? #2 0x7fff955299eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (O) from 1.8000 to 0.9906 Info(checkmt): reduced muffin-tin radius of species 2 (H) from 1.4000 to 0.7704 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 8.727117532 Required : 10.00000000 Warning(gndstate): failed to reach self-consistency after 2 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 7.893320245 Required : 10.00000000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -79.0782174419 TEST_000.OUT : -46.7988991490 absolute difference : 32.2793182929 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.790782174419E-03 Running test in directory test_011... ERROR STOP Error termination. Backtrace: #0 0x7fffaf296873 in ??? #1 0x7fffaf297f43 in ??? #2 0x7fffaf2999eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.80924075 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 2 loops Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 25.80736252 Required : 28.00000000 Info(elk): current task : 5 Info(genkmat): 2 of 2 k-points Info(genkmat): 1 of 2 k-points Info(hartfock): self-consistent loop number : 1 Info(eveqnhf): 2 of 2 k-points Info(eveqnhf): 1 of 2 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 25.22664098 Required : 28.00000000 Info(hartfock): self-consistent loop number : 2 Info(eveqnhf): 2 of 2 k-points Info(eveqnhf): 1 of 2 k-points Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 24.52498171 Required : 28.00000000 Info(exxengy): 1 of 2 k-points Info(exxengy): 2 of 2 k-points Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -579.532549312 TEST_000.OUT : -578.771840196 absolute difference : 0.760709116000 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.579532549312E-02 Running test in directory test_012... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 12.52656735 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 12.52657318 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 12.52668036 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 12.52679907 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 12.52689609 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 12.52694644 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 12.52697130 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 12.52697590 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 12.52697954 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 12.52698347 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 12.52698453 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 12.52698447 Required : 13.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 12.52698439 Required : 13.00000000 Info(elk): current task : 200 Info(phononsc): working on DYN_Q0000_0000_0000_S01_A001_P1.OUT Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 97 The leading minor of the overlap matrix of order 47 is not positive definite Order of overlap matrix : 50 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 113 The leading minor of the overlap matrix of order 55 is not positive definite Order of overlap matrix : 58 Running test in directory test_013... Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.3828 Info(checkmt): reduced muffin-tin radius of species 2 (Al) from 2.2000 to 2.1842 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 129 The leading minor of the overlap matrix of order 53 is not positive definite Order of overlap matrix : 76 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 131 Running test in directory test_014... ERROR STOP Error termination. Backtrace: #0 0x7fffacdb6873 in ??? #1 0x7fffacdb7f43 in ??? #2 0x7fffacdb99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 26.14171296 Required : 28.00000000 Info(oepvcl): 1 of 8 k-points Info(oepvcl): 5 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepmain): done 10 iterations of 100 Info(oepmain): done 20 iterations of 100 Info(oepmain): done 30 iterations of 100 Info(oepmain): done 40 iterations of 100 Info(oepmain): done 50 iterations of 100 Info(oepmain): done 60 iterations of 100 Info(oepmain): done 70 iterations of 100 Info(oepmain): done 80 iterations of 100 Info(oepmain): done 90 iterations of 100 Info(oepmain): done 100 iterations of 100 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 26.12742738 Required : 28.00000000 Info(oepvcl): 1 of 8 k-points Info(oepvcl): 5 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepmain): done 10 iterations of 100 Info(oepmain): done 20 iterations of 100 Info(oepmain): done 30 iterations of 100 Info(oepmain): done 40 iterations of 100 Info(oepmain): done 50 iterations of 100 Info(oepmain): done 60 iterations of 100 Info(oepmain): done 70 iterations of 100 Info(oepmain): done 80 iterations of 100 Info(oepmain): done 90 iterations of 100 Info(oepmain): done 100 iterations of 100 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 26.08191937 Required : 28.00000000 Info(oepvcl): 5 of 8 k-points Info(oepvcl): 1 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepmain): done 10 iterations of 100 Info(oepmain): done 20 iterations of 100 Info(oepmain): done 30 iterations of 100 Info(oepmain): done 40 iterations of 100 Info(oepmain): done 50 iterations of 100 Info(oepmain): done 60 iterations of 100 Info(oepmain): done 70 iterations of 100 Info(oepmain): done 80 iterations of 100 Info(oepmain): done 90 iterations of 100 Info(oepmain): done 100 iterations of 100 Warning(gndstate): failed to reach self-consistency after 4 loops Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 26.07565412 Required : 28.00000000 Info(oepvcl): 1 of 8 k-points Info(oepvcl): 5 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepmain): done 10 iterations of 100 Info(oepmain): done 20 iterations of 100 Info(oepmain): done 30 iterations of 100 Info(oepmain): done 40 iterations of 100 Info(oepmain): done 50 iterations of 100 Info(oepmain): done 60 iterations of 100 Info(oepmain): done 70 iterations of 100 Info(oepmain): done 80 iterations of 100 Info(oepmain): done 90 iterations of 100 Info(oepmain): done 100 iterations of 100 Info(exxengy): 5 of 8 k-points Info(exxengy): 1 of 8 k-points Info(exxengy): 2 of 8 k-points Info(exxengy): 3 of 8 k-points Info(exxengy): 6 of 8 k-points Info(exxengy): 4 of 8 k-points Info(exxengy): 7 of 8 k-points Info(exxengy): 8 of 8 k-points Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -530.380788873 TEST_000.OUT : -532.113797752 absolute difference : 1.73300887900 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.530380788873E-02 Running test in directory test_015... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffa4676873 in ??? #1 0x7fffa4677f43 in ??? #2 0x7fffa46799eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.2267 Info(checkmt): reduced muffin-tin radius of species 2 (O) from 1.8000 to 1.6700 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -24.11500610 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 254.3518233 Required : 72.00000000 Info(findlambda): lambda obtained in 8 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 51.33599999 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 9 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 51.62620458 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 50.82916960 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 49.03698264 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 44.37808886 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 45.94382068 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 44.55582785 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 53.20812991 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 14 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 47.31106301 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 78.53227645 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 12 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 54.18437942 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 48.12762637 Required : 72.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 48.11297017 Required : 72.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 45.83138794 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 63.21284515 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 45.97128077 Required : 72.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 46.32174721 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 47.57506412 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 51.61085460 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 49.23664344 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 50.18082929 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 50.52007003 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 50.44653891 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 52.16406547 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 49.04981936 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 51.39387945 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 52.01369883 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 50.40109007 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 51.17725414 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 51.58044567 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 50.63843989 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 51.49286450 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 51.06908396 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 50.31946807 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 51.51084970 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 51.34260784 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 49.80704435 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 50.96034706 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 53.22308754 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 49.80074461 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 50.92215298 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 50.70522314 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 50.88612169 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 51.70534604 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 50.60490014 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 50.41252301 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 52.90221359 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 49.89521921 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 50.19489574 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 52.37106571 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 50.33593933 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 49.94417470 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 50.99945212 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 51.08515351 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 50.18712759 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 51.03658605 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 51.48937627 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 51.33264127 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 50.98568547 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 51.93008832 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 50.99660244 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 50.96073241 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 50.33924828 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 50.23679301 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 49.98658661 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 53.60653784 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 50.34821875 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 50.14937975 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 51.79034524 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 50.03067877 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 51.04890557 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 51.27296804 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 51.20883414 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 50.21103240 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 51.27304421 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 50.73317292 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 50.96101247 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 51.37246414 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 50.08785599 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 50.16561570 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 50.70054791 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 50.74123862 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 50.52211106 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 50.78424551 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 50.86859731 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 50.73911510 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 51.75227155 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 50.58489214 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 53.37473541 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 50.38661756 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 50.95685659 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 51.35128717 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 50.39736781 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 51.92356017 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 51.67419492 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 51.15045450 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 50.70601255 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 51.40013085 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 50.61173885 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 50.91390141 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 50.59394761 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 51.76687474 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 49.57606043 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 51.44446782 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 49.52726770 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 50.25569633 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 51.11291797 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 49.53834951 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 51.34711942 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 51.15735462 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 51.11590710 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 50.02816569 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 50.70402060 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 51.20188431 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 51.12946174 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 51.80399651 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 51.05563261 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 51.30017190 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 51.35416514 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 50.56514878 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 51.52508975 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 50.53545666 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 50.74601443 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 50.97464701 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 50.88135976 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 50.26663758 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 51.13576519 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 50.14059390 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 50.29376052 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 51.82968716 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 51.26302934 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 51.40936502 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 50.83422246 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 50.01045572 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 50.76814868 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 51.28865444 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 52.70333428 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 49.89567345 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 50.76257590 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 52.66014995 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 50.23201671 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 51.42931009 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 51.24218056 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 50.14529185 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 50.35449477 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 51.67894307 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 51.12974136 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 50.85041925 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 51.43163961 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 50.71139673 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 50.81770197 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 51.92645294 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 51.32551668 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 51.74428834 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 51.42541161 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 50.62474537 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 50.79963016 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 49.78773988 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 52.76336904 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 50.57263325 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 50.79800417 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 50.42396834 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 51.09257195 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 51.40020207 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 50.32478383 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 51.74266165 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 51.31603034 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 49.96050494 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 50.64467325 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 52.28230553 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 49.98626050 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 50.69734716 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 50.85414943 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 51.51480136 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 50.49293949 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 50.66794571 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 51.36580265 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 51.70062106 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 49.99674750 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 52.10555961 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 51.21292839 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 50.16074640 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 51.77005436 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 50.93798325 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 50.25399206 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 50.39533728 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 52.44794575 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 50.31801344 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 50.49612798 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 50.34416256 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 51.30926413 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 50.04511957 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 50.93664454 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 51.28583945 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 50.68702677 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 50.78277819 Required : 72.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 50.59707344 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 51.66684400 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 50.50195646 Required : 72.00000000 Info(findlambda): lambda obtained in 5 iterations Info(elk): current task : 400 Info(writetm): Tensor moment decomposition of density matrix in the spherical basis written to TENSMOM.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -3186.18768675 TEST_000.OUT : -3100.31207358 absolute difference : 85.8756131700 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.318618768675E-01 Running test in directory test_016... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff9d2f6873 in ??? #1 0x7fff9d2f7f43 in ??? #2 0x7fff9d2f99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (U) from 3.0000 to 2.9601 Info(checkmt): reduced muffin-tin radius of species 2 (S) from 2.2000 to 2.1708 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 96.68465848 Required : 108.0000000 Info(findlambda): lambda obtained in 8 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 96.56750490 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 96.42541832 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 96.18780467 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 96.45918448 Required : 108.0000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 94.56939359 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 95.78886692 Required : 108.0000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 95.71495421 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 95.40508185 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Warning(gndstate): failed to reach self-consistency after 10 loops Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 95.34927144 Required : 108.0000000 Info(findlambda): lambda obtained in 6 iterations Info(elk): current task : 400 Info(writetm): Tensor moment decomposition of density matrix in the spherical basis written to TENSMOM.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -28328.4711959 TEST_000.OUT : -28506.5637701 absolute difference : 178.092574200 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.283284711959 Running test in directory test_017... Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.4000 to 2.2888 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.4000 to 2.2888 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 211 The leading minor of the overlap matrix of order 92 is not positive definite Order of overlap matrix : 119 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 223 The leading minor of the overlap matrix of order 98 is not positive definite Order of overlap matrix : 125 Running test in directory test_018... ERROR STOP Error termination. Backtrace: #0 0x7fffb6f06873 in ??? #1 0x7fffb6f07f43 in ??? #2 0x7fffb6f099eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 40.27411364 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 40.27582733 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 40.40714652 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 40.53251090 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 40.59937047 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 40.65578279 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 40.68438215 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 40.68797771 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 40.68842795 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 40.68884392 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 40.68864150 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 40.68858904 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 40.68858187 Required : 41.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 40.68858046 Required : 41.00000000 Info(elk): current task : 205 Info(phonon): working on DYN_Q0000_0000_0000_S01_A001_P1.OUT Info(phonon): working on DYN_Q0102_0000_0000_S01_A001_P1.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0102_0102_0102_S01_A001_P1.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0000_0000_0000_S01_A001_P2.OUT Info(phonon): working on DYN_Q0102_0000_0000_S01_A001_P2.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0102_0102_0102_S01_A001_P2.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0000_0000_0000_S01_A001_P3.OUT Info(phonon): working on DYN_Q0102_0000_0000_S01_A001_P3.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(phonon): working on DYN_Q0102_0102_0102_S01_A001_P3.OUT Warning(phonon): failed to reach self-consistency after 200 loops Info(dyntask): nothing more to do Info(elk): current task : 210 Info(phdos): phonon density of states written to PHDOS.OUT thermodynamic properties written to THERMO.OUT Info(elk): current task : 500 Error(testcheck): variable 10 outside tolerance for quantity 'phonon DOS' TEST_210.OUT_ (correct value) : 0.448026778003E-03 TEST_210.OUT : 266.330465155 absolute difference : 266.330017128 required relative tolerance : 0.100000000000E-01 required absolute tolerance : 0.448026778003E-05 Running test in directory test_019... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.3297 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.898542575 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 71.72901335 Required : 28.00000000 Info(findlambda): lambda obtained in 8 iterations Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -15.87959399 -4.590500000 for s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 22.30737675 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 19.66902336 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 19.46427535 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 19.42479685 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 19.84020137 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 19.64102920 Required : 28.00000000 Info(findlambda): lambda obtained in 4 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 17.22908804 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.908042807 -4.590500000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 17.60110600 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 10 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 20.72325218 Required : 28.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 15 iterations Warning(linengy): could not find 2 linearisation energies in s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 21.08041553 Required : 28.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 4 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 16.89951635 Required : 28.00000000 Info(findlambda): lambda obtained in 10 iterations Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 17.04120892 Required : 28.00000000 Info(findlambda): lambda obtained in 5 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 21.01536131 Required : 28.00000000 Warning(engyfdu): could not find 1 energies Info(findlambda): lambda obtained in 15 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 21.36813486 Required : 28.00000000 Info(findlambda): lambda obtained in 7 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 20.78164336 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 20.17017646 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 20.19697001 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 20.45372041 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 20.20429165 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 20.06508608 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 20.58562061 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 20.42328706 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 20.46184667 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 20.18888180 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 19.96389572 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 20.23934133 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 19.93455301 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 20.47746733 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 20.03918085 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 20.51255240 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 20.17186317 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 20.69348806 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 20.69719972 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 20.53825671 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 20.23440272 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 20.42452522 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 20.88837162 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 20.52111886 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 19.97166508 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 20.26682258 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 20.36978976 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 20.65499675 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 20.41257502 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 20.37139052 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 20.25241090 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 20.67702368 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 20.44090441 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 20.41854526 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 20.54340470 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 20.41281420 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 20.43292841 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 20.35672089 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 20.46900072 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 20.40581311 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 20.54236079 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 20.37275407 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 20.37517997 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 20.20597767 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 20.36740421 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 20.46730622 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 20.20968860 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 20.11883224 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 20.11949167 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 20.44308307 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 19.96549329 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 19.89023639 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 20.49772061 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 20.34233713 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 20.41812198 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 20.56626222 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 20.53701951 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 20.79712303 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 20.43161631 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 20.40176265 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 20.24864135 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 20.26744959 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 20.54941150 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 20.66231849 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 20.05881168 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 20.37501494 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 20.21670295 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 20.31733928 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 20.31927399 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 20.83195973 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 20.49015488 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 20.63064814 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 20.63810518 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 19.93017538 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 20.08280977 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 20.70129570 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 20.25751444 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 19.84418256 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 20.59745576 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 20.20093195 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 20.08510433 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 20.36332241 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 20.18747344 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 20.48114523 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 20.95143282 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 20.11950657 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 20.39846158 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 20.52775671 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 20.56797058 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 20.37653895 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 20.51357243 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 20.41973994 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 20.20417299 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 20.35269408 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 20.45524749 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 20.72104388 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 20.64849359 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 20.07173861 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 20.69364355 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 20.28063563 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 20.30819344 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 20.10408138 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 20.52205911 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 20.67544688 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 20.35518856 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 20.27277955 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 20.71285677 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 20.70909129 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 20.79659933 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 20.37331105 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 20.45348624 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 20.49001230 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 20.38585456 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 20.54887345 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 20.35345780 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 20.70104792 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 20.61724752 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 20.49051360 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 20.16066668 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 20.24852455 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 20.41700757 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 20.35826418 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 20.47395302 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 20.37974205 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 20.19556103 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 19.93309216 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 20.42872940 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 20.48037523 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 20.51763316 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 20.59986282 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 20.43741415 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 20.41129020 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 20.74102534 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 20.80900298 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 20.28237533 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 20.40765858 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 20.27781722 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 20.53993090 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 20.66832062 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 20.37404648 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 20.16091389 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 20.37329465 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 20.42171242 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 20.29470987 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 20.46239124 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 20.27018727 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 20.45934276 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 20.11024169 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 20.47644601 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 20.74160533 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 19.90743432 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 20.23945252 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 19.86900366 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 20.30288335 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 20.27494585 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 20.49533809 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 20.47072556 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 20.35385588 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 20.50614216 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 20.42338597 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 20.74113060 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 20.23133091 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 20.54792093 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 19.97668270 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 20.17068224 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 20.50147019 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 20.67240184 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 20.42918504 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 20.27570154 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 20.52233030 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 20.23839316 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 20.71803857 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 20.19367541 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 20.07433856 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 20.20618190 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 20.46364568 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 20.36026532 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 20.49172413 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 20.35764314 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 20.34884097 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 20.34761006 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 20.23163454 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 20.35850557 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 20.43625542 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 20.27461387 Required : 28.00000000 Info(findlambda): lambda obtained in 6 iterations Info(elk): current task : 450 Info(genafieldt): Time-dependent A-field written to AFIELDT.OUT Laser pulse and ramp parameters written to TD_INFO.OUT 1 atomic unit of time is 24.18884327 attoseconds Total simulation time : 50.00000000 in attoseconds : 1209.442163 Info(elk): current task : 460 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 59 The leading minor of the overlap matrix of order 22 is not positive definite Order of overlap matrix : 37 Running test in directory test_020... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffa9ea6873 in ??? #1 0x7fffa9ea7f43 in ??? #2 0x7fffa9ea99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Li) from 1.8000 to 1.7782 Info(checkmt): reduced muffin-tin radius of species 2 (F) from 2.0000 to 1.9758 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 23.84125720 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 35.78035563 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 34.01256200 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 25.44731695 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 22.38362356 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 20.17233540 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 18.21912205 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 17.83526292 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 18.28788204 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 15.51031692 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 14.37025776 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 14.27282431 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 13.88216273 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 13.21535892 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 13.27164254 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 12.93030817 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 10.21583828 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 192348.9811 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 19 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -453069.2099 -3.878400000 for s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 1.023852387 Required : 12.00000000 Warning(rdirac): maximum iterations exceeded Warning(linengy): could not find 3 linearisation energies in s.c. loop 20 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -1119401.671 -3.878400000 for s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 0.3534575701E-51 Required : 12.00000000 Warning(rdirac): maximum iterations exceeded Warning(linengy): could not find 3 linearisation energies in s.c. loop 21 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -165883.3711 -3.878400000 for s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 0.4981087732E-52 Required : 12.00000000 Warning(rdirac): maximum iterations exceeded Warning(linengy): could not find 3 linearisation energies in s.c. loop 22 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -14571.32880 -3.878400000 for s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 0.9077549268E-65 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 23 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -1777.063816 -3.878400000 for s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 0.1407718792E-04 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 24 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4717.965047 -3.878400000 for s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 1.403876150 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 25 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -396.9633890 -3.878400000 for s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 2.026918777 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 26 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -333.1853076 -3.878400000 for s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 0.8781741092-149 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 27 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.554228226 -3.878400000 for s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 11.12615548 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 9.979905459 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 12.37686216 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 9.655354732 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 11.70665526 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 13.20133072 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 11.22146577 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 14.13991409 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 11.20575467 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 10.98642490 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 21.48155210 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 30.99157000 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 142.0282853 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 9.764081220 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 29.69752333 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 145.5613094 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 9.869416844 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 9.865255085 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 11.17763929 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 78.98229077 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 5273.230451 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 48 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -16.89559089 -3.878400000 for s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 11.77966813 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 49 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.362772723 -3.878400000 for s.c. loop 49 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 49 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 7.758355706 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 50 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -12.19607576 -3.878400000 for s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 0.4471237671E-03 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 51 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -12.37854336 -3.878400000 for s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 0.2233233186E-02 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 52 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -11.92116339 -3.878400000 for s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 0.6527676465E-03 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 53 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.330655402 -3.878400000 for s.c. loop 53 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 53 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 9.446423204 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 36.27113493 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 365.9990492 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 56 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -14.91783130 -3.878400000 for s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 0.5239173510E-03 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 57 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.323335070 -3.878400000 for s.c. loop 57 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 6 and s.c. loop 57 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 9.240766821 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 9.563934034 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 18.92902912 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 21.80748905 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 13.89531073 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 10.27281965 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 12.09794097 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 38.68510714 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 10.60564309 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 10.38940941 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 10.03226043 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 10.57744329 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 48.19142943 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 10.17645639 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 9.928671870 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 12.27903057 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 22.13912303 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 9.826137963 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 11.96919063 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 11.03416173 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 373.6120211 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 78 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -3.880481237 -3.878400000 for s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 18.54561365 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 18.30159119 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 92.96668485 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 24.55026275 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 21.04495470 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 339.9192597 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 9.511333465 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 12.20776653 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 10.65476448 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 14.08896065 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 19.17810700 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 13.11567900 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 13.24554047 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 3341.701367 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 92 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -80.87571313 -3.878400000 for s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 0.9075948261E-03 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 93 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -56.16299438 -3.878400000 for s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 0.8043968478E-03 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 94 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -27.13278234 -3.878400000 for s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 0.7846001808E-03 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 95 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -25.97770636 -3.878400000 for s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 0.8753104018E-03 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 96 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -14.55134565 -3.878400000 for s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 0.2024773579E-02 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 9.459380146 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 8.816177236 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 12.11584430 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 33.11127184 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 587.4329507 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 9.688606147 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 19.03837089 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 10.78423577 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 12.65875570 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 24.39773131 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 194079.0319 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 108 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -204371.7178 -3.878400000 for s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 0.1139164396E-04 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 109 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -35424.06172 -3.878400000 for s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 0.1087854862E-04 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 110 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -61040.30599 -3.878400000 for s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 0.9650552178E-05 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 111 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -44786.16818 -3.878400000 for s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 0.9394102443E-05 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 112 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -19889.70553 -3.878400000 for s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 0.1147757225E-04 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 113 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -650.8204475 -3.878400000 for s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 0.2703605392E-04 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 114 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -27.38553154 -3.878400000 for s.c. loop 114 Warning(occupy): not enough empty states for k-point 2 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 3 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 4 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 5 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 7 and s.c. loop 114 Warning(occupy): not enough empty states for k-point 8 and s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 11.97513997 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 115 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -13.02870561 -3.878400000 for s.c. loop 115 Warning(occupy): not enough empty states for k-point 1 and s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 11.92462295 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 11.83989974 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 19.65472796 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 11.06167500 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 12.08083436 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 17.61692913 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 10.22559274 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 38.48198582 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 9.842779364 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 9.861059474 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 50.86508417 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 10.21499982 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 10.10865322 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 10.01137039 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 18.93429551 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 10.68100777 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 2361.698277 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 132 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -95.91502291 -3.878400000 for s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 0.1654665735E-03 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 133 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -51.42437658 -3.878400000 for s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 0.3681360213E-03 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 134 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -28.94441806 -3.878400000 for s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 0.2500041698E-03 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 135 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -19.46077619 -3.878400000 for s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 0.3554568581E-03 Required : 12.00000000 Warning(linengy): could not find 3 linearisation energies in s.c. loop 136 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -11.03988038 -3.878400000 for s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 0.6174852690E-03 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 7.013382029 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 24.97513115 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 9.576783468 Required : 12.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 12.10604625 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 9.964178911 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 12.56958647 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 10.62422431 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 32.47522599 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 9.970589892 Required : 12.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 9.904562904 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 12.42386076 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 12.96195199 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 11.07929059 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 13.31119185 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 11.02585254 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 10.82080321 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 10.82000857 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 14.47087307 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 11.19201689 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 12.66090473 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 10.80791314 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 13.90208905 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 10.87151833 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 12.62313532 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 11.56605719 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 12.34937446 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 12.16333602 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 12.24422470 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 12.19847827 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 12.20868751 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 12.20386070 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 12.20310937 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 12.20232454 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 12.20231002 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 12.20238006 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 12.20239562 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 12.20239453 Required : 12.00000000 Info(elk): current task : 600 Info(genpmat): 1 of 8 k-points Info(genpmat): 5 of 8 k-points Info(genpmat): 2 of 8 k-points Info(genpmat): 6 of 8 k-points Info(genpmat): 7 of 8 k-points Info(genpmat): 3 of 8 k-points Info(genpmat): 4 of 8 k-points Info(genpmat): 8 of 8 k-points Info(epsinv): 1 of 3 q-points Info(epsinv): 2 of 3 q-points Info(epsinv): 3 of 3 q-points Info(gwsefm): 1 of 8 k-points Info(gwsefm): 5 of 8 k-points Info(gwsefm): 6 of 8 k-points Info(gwsefm): 2 of 8 k-points Info(gwsefm): 7 of 8 k-points Info(gwsefm): 3 of 8 k-points Info(gwsefm): 4 of 8 k-points Info(gwsefm): 8 of 8 k-points Info(gwsefm): GW self-energy at the fermionic frequencies written to GWSEFM.OUT Info(elk): current task : 610 Info(gwspecf): 5 of 8 k-points Info(gwspecf): 1 of 8 k-points Info(gwspecf): 2 of 8 k-points Info(gwspecf): 6 of 8 k-points Info(gwspecf): 3 of 8 k-points Info(gwspecf): 7 of 8 k-points Info(gwspecf): 4 of 8 k-points Info(gwspecf): 8 of 8 k-points Info(gw): GW spectral functions and Kohn-Sham eigenvalues written to GWSF_Kkkkkkk.OUT for all k-points Total GW spectral function written to GWTSF.OUT Fermi energy for the Kohn-Sham eigenvalues is at zero in plots Fermi energy for the GW spectral function is undetermined Spectral function units are states/Hartree/unit cell Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -106.905850836 TEST_000.OUT : -106.974687180 absolute difference : 0.688363440000E-01 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.106905850836E-02 Running test in directory test_021... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffa63d6873 in ??? #1 0x7fffa63d7f43 in ??? #2 0x7fffa63d99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Mn) from 2.4000 to 2.3708 Info(checkmt): reduced muffin-tin radius of species 2 (O) from 1.8000 to 1.7781 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 45.45915193 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 45.68516427 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 46.43670838 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.581159718 -5.137200000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 109.0701654 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 47.62154349 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 45.03832489 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 53.04913621 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 44.86089606 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 44.93141919 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 44.16082027 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 43.64992394 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 42.68434461 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 42.29941532 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 42.46739679 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 43.14568358 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 43.40675948 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 43.41806395 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 43.40035713 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 43.49849008 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 43.84767635 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 43.42826766 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 43.24588467 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 43.23079016 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 43.49093155 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.443176951 -5.137200000 for s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 43.47191763 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 43.22054835 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 42.73819341 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 42.34586655 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 43.55366698 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 43.43994412 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 43.68071179 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 43.68299229 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 43.16741837 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 43.17575291 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.282163015 -5.137200000 for s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 44.16421526 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 42.48092276 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 43.84083421 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.160974236 -5.137200000 for s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 43.41736530 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 42.09762114 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.675151534 -5.137200000 for s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 43.05329643 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 44.05524123 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 43.58181149 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 43.76446881 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 43.52940772 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 43.37106013 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 43.39716479 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 42.94777385 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 43.32677738 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 43.43076792 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.463646090 -5.137200000 for s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 44.00203589 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 43.72098793 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 44.21562194 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 44.31002320 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 43.50900863 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 43.56097113 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 43.54040342 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 43.35708514 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.534008592 -5.137200000 for s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 43.58767307 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.840636243 -5.137200000 for s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 42.43809168 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.391945521 -5.137200000 for s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 42.99337841 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 43.70204493 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.949899705 -5.137200000 for s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 42.87476586 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 42.55118595 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 42.05817207 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 43.51370268 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 43.05412783 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 43.66457739 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 43.66533693 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 44.02237597 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 43.52542917 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 43.61802246 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 44.02786671 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 42.44131889 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 43.06449626 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 43.64761922 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 43.23679581 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.411306225 -5.137200000 for s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 43.27405625 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 43.08789269 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 43.26797644 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 43.64764189 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.873290619 -5.137200000 for s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 42.68487046 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 42.87774453 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 43.55188443 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 42.96827814 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 43.15196386 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 42.70566855 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 43.53047175 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 43.54637215 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 43.29380964 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.342226651 -5.137200000 for s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 43.96111594 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 42.85236593 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 43.19942760 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 43.73780223 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.349348455 -5.137200000 for s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 43.14639128 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 42.75701468 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.471466977 -5.137200000 for s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 43.21039438 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.360150438 -5.137200000 for s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 42.87991200 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.217811342 -5.137200000 for s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 42.66204457 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 43.09639618 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 42.70159967 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 43.04055877 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 43.52830924 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 43.12671451 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 43.01683355 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 43.25258170 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 42.97612929 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 43.09341847 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 43.54513247 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 42.67493765 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 42.73001326 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 43.72536270 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 43.24424637 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 43.82446883 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 43.50723399 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 43.42855293 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 42.44328625 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 43.43166905 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 44.11720051 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 42.62485154 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 43.68278840 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 43.31448742 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 43.78092618 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 43.23452575 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 43.31007214 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 43.26773559 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 44.65803939 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 43.51839808 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 43.93927623 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 43.47239523 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 43.15686003 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 42.96240909 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 43.48895574 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 43.40003802 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 43.33124215 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 43.29807336 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 43.21449450 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 43.20250800 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 43.43216185 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 43.05277385 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 43.26040031 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 43.21673476 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 43.62563114 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 43.34339389 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 43.52966191 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 43.65723844 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 42.90394829 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 43.09956006 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 42.76106609 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.432604222 -5.137200000 for s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 42.46989485 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 42.76822762 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 43.02239646 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 42.96346121 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 42.49591517 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.428988099 -5.137200000 for s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 42.50422310 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 43.18492573 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.598402638 -5.137200000 for s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 42.64630177 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 42.67701844 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 43.05873360 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 43.99997809 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 42.88596118 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 43.27303422 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 42.38559036 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 42.92174749 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.503096047 -5.137200000 for s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 43.15716420 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 43.25157939 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 43.01524771 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 43.03642056 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 41.97630967 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 43.07935954 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 43.06895198 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.238720417 -5.137200000 for s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 43.51547325 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 43.26650138 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 43.20933062 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 43.25505255 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 42.93489584 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 42.76316686 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 42.78156295 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 43.53673580 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 43.55715119 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 43.50412751 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 43.60867728 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 43.07869133 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 42.00050923 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 43.04942587 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 43.63986294 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 43.24884080 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 43.14512540 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 43.66309262 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 43.60883418 Required : 66.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.226729469 -5.137200000 for s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 43.05136632 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 43.28160190 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 43.16959293 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 43.92189434 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 43.22216736 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 43.66004905 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 44.08797200 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 43.37754911 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 44.05053071 Required : 66.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 44.01156074 Required : 66.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 43.33555303 Required : 66.00000000 Info(elk): current task : 195 Info(sfacrho): density structure factors written to SFACRHO.OUT Energy window : -1000000.000 1000000.000 Info(elk): current task : 196 Info(sfacmag): magnetic structure factors written to SFACMAG_j.OUT for magnetic components j = 1 (this corresponds to the z-component of the magnetisation) Energy window : -1000000.000 1000000.000 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -2462.70061065 TEST_000.OUT : -2477.85156779 absolute difference : 15.1509571400 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.246270061065E-01 Running test in directory test_022... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffa05d6873 in ??? #1 0x7fffa05d7f43 in ??? #2 0x7fffa05d99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.3297 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -7.036711134 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 27.38528980 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.307181176 -4.590500000 for s.c. loop 2 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 26.00147693 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -10.94622789 -4.590500000 for s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 24.54364714 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -11.70817789 -4.590500000 for s.c. loop 4 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 24.06129734 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -9.972295396 -4.590500000 for s.c. loop 5 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 27.20877539 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 23.30281304 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 19.70379422 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 19.58838612 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 19.57981660 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 19.62330764 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 19.43577171 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 19.82121559 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 19.59401968 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.617986742 -4.590500000 for s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 18.93331233 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.737212281 -4.590500000 for s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 17.49986331 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.879603662 -4.590500000 for s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 17.90450547 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.839830820 -4.590500000 for s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 18.12618296 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.773840346 -4.590500000 for s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 18.04867317 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.739249129 -4.590500000 for s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 17.39802264 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.472185547 -4.590500000 for s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 18.72245141 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 19.23250046 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.858935474 -4.590500000 for s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 18.77023810 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 18.45192786 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 18.23803982 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.590747833 -4.590500000 for s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 18.28553199 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.631976612 -4.590500000 for s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 18.30934904 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 19.07972347 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 18.36969572 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 18.88304796 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 18.69283194 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 18.98043699 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 17.80335566 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.991502593 -4.590500000 for s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 18.83683329 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 18.60534958 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.704817790 -4.590500000 for s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 18.79491342 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.196559051 -4.590500000 for s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 18.59098105 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 18.87453646 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.744964874 -4.590500000 for s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 18.84191395 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.636403029 -4.590500000 for s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 18.07815907 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.693728071 -4.590500000 for s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 18.39048361 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.924054650 -4.590500000 for s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 18.41744126 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.404929440 -4.590500000 for s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 18.33804690 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.655952600 -4.590500000 for s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 18.24633396 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 18.17791408 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.627966109 -4.590500000 for s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 18.42128551 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -9.470592972 -4.590500000 for s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 18.46082331 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 18.88790503 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 19.26296451 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 17.68177350 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.713456690 -4.590500000 for s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 17.21295667 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.600373849 -4.590500000 for s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 17.21410557 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.770596096 -4.590500000 for s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 17.81404363 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.597872330 -4.590500000 for s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 17.94981061 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.973891660 -4.590500000 for s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 17.55603091 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.131289151 -4.590500000 for s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 17.62228215 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.746651937 -4.590500000 for s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 18.12570832 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.887226222 -4.590500000 for s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 18.24427337 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.113373780 -4.590500000 for s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 18.44808331 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.105268288 -4.590500000 for s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 18.43032096 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.952836669 -4.590500000 for s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 18.45408447 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.101245913 -4.590500000 for s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 18.23684024 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.879042447 -4.590500000 for s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 17.96899792 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.818975579 -4.590500000 for s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 17.68080626 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.315374310 -4.590500000 for s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 17.62084749 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.041399087 -4.590500000 for s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 17.74198790 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.896001620 -4.590500000 for s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 17.67694105 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 18.89012214 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 19.20316111 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 20.52644870 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 20.30281034 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 18.96081714 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.568189289 -4.590500000 for s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 17.47341437 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 17.60714035 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 18.85497213 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 19.79904062 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 19.16253207 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.844735164 -4.590500000 for s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 17.65959359 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 17.41039012 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 17.92129115 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 17.81450389 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 17.77606790 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 17.54363227 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 18.34901722 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 20.43731864 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 18.62215931 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.670947555 -4.590500000 for s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 17.91356180 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 18.75599461 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 20.29144568 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 89 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -8.118882022 -4.590500000 for s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 22.52492599 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 90 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -6.363927215 -4.590500000 for s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 21.53545791 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 18.14013925 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 19.32008619 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 20.45772466 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 20.03163040 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 19.98758365 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 20.09954891 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 19.62031320 Required : 28.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 20.28863435 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 19.94058055 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 19.95817326 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 19.86896795 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 20.06200723 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 20.04245014 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 20.04692469 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 20.12613420 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 19.42845428 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 20.09643738 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 20.19691674 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 20.48847213 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 20.23280109 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 20.23053505 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 20.09592842 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 20.06996901 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 20.08962510 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 20.28792694 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 20.34505199 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 20.13850675 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 20.13186471 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 19.65422757 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 19.72355565 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 19.76408181 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 19.44374171 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 19.06874776 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 19.90961297 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 20.47757983 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 20.33812011 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 20.22740838 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 19.95781380 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 19.48205430 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 19.80466682 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 20.05173495 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 20.11758839 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 19.87713911 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 19.78487680 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 20.34065872 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 19.48022276 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 20.41902722 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 20.47769547 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 20.49905304 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 20.35084217 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 20.19702842 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 20.07409208 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 20.50005207 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 20.25310358 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 20.32279051 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 20.27706564 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 20.07548297 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 19.72713099 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 19.52330606 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 19.79673426 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 20.06474223 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 20.14972587 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 20.45600913 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 19.54781441 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 20.52449428 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 19.78249229 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 20.39711141 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 19.82565032 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 20.54096875 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 19.82868633 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 20.34212727 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 20.19378160 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 20.61796809 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 20.17599780 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 20.39047694 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 20.07065723 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 20.23072387 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 20.44690869 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 20.39184634 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 20.43984671 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 20.58249980 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 20.61962867 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 19.61329835 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 20.23947304 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 19.94478347 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 20.53727763 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 19.55192814 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 19.85186521 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 20.26380514 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 20.50885824 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 20.11687813 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 20.13379268 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 20.28496855 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 20.29590894 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 20.57430497 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 20.54964271 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 19.90600156 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 19.99754464 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 19.80383560 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 19.60630976 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 19.52605767 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 19.73798522 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 19.88513407 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 19.39292569 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 19.52624222 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 19.56960884 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 19.29495073 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 19.01683662 Required : 28.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 18.97042030 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 19.45904351 Required : 28.00000000 Info(elk): current task : 330 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Info(tddftsplr): 1 of 1000 k-points Info(tddftsplr): 501 of 1000 k-points Info(tddftsplr): 2 of 1000 k-points Info(tddftsplr): 502 of 1000 k-points Info(tddftsplr): 503 of 1000 k-points Info(tddftsplr): 3 of 1000 k-points Info(tddftsplr): 504 of 1000 k-points Info(tddftsplr): 4 of 1000 k-points Info(tddftsplr): 505 of 1000 k-points Info(tddftsplr): 5 of 1000 k-points Info(tddftsplr): 506 of 1000 k-points Info(tddftsplr): 6 of 1000 k-points Info(tddftsplr): 507 of 1000 k-points Info(tddftsplr): 7 of 1000 k-points Info(tddftsplr): 508 of 1000 k-points Info(tddftsplr): 8 of 1000 k-points Info(tddftsplr): 509 of 1000 k-points Info(tddftsplr): 9 of 1000 k-points Info(tddftsplr): 510 of 1000 k-points Info(tddftsplr): 10 of 1000 k-points Info(tddftsplr): 511 of 1000 k-points Info(tddftsplr): 11 of 1000 k-points Info(tddftsplr): 512 of 1000 k-points Info(tddftsplr): 12 of 1000 k-points Info(tddftsplr): 513 of 1000 k-points Info(tddftsplr): 13 of 1000 k-points Info(tddftsplr): 514 of 1000 k-points Info(tddftsplr): 14 of 1000 k-points Info(tddftsplr): 515 of 1000 k-points Info(tddftsplr): 15 of 1000 k-points Info(tddftsplr): 516 of 1000 k-points Info(tddftsplr): 16 of 1000 k-points Info(tddftsplr): 517 of 1000 k-points Info(tddftsplr): 17 of 1000 k-points Info(tddftsplr): 18 of 1000 k-points Info(tddftsplr): 518 of 1000 k-points Info(tddftsplr): 19 of 1000 k-points Info(tddftsplr): 519 of 1000 k-points Info(tddftsplr): 20 of 1000 k-points Info(tddftsplr): 520 of 1000 k-points Info(tddftsplr): 21 of 1000 k-points Info(tddftsplr): 521 of 1000 k-points Info(tddftsplr): 22 of 1000 k-points Info(tddftsplr): 522 of 1000 k-points Info(tddftsplr): 23 of 1000 k-points Info(tddftsplr): 523 of 1000 k-points Info(tddftsplr): 24 of 1000 k-points Info(tddftsplr): 524 of 1000 k-points Info(tddftsplr): 25 of 1000 k-points Info(tddftsplr): 525 of 1000 k-points Info(tddftsplr): 26 of 1000 k-points Info(tddftsplr): 526 of 1000 k-points Info(tddftsplr): 527 of 1000 k-points Info(tddftsplr): 27 of 1000 k-points Info(tddftsplr): 528 of 1000 k-points Info(tddftsplr): 28 of 1000 k-points Info(tddftsplr): 29 of 1000 k-points Info(tddftsplr): 529 of 1000 k-points Info(tddftsplr): 530 of 1000 k-points Info(tddftsplr): 30 of 1000 k-points Info(tddftsplr): 31 of 1000 k-points Info(tddftsplr): 531 of 1000 k-points Info(tddftsplr): 32 of 1000 k-points Info(tddftsplr): 532 of 1000 k-points Info(tddftsplr): 33 of 1000 k-points Info(tddftsplr): 533 of 1000 k-points Info(tddftsplr): 34 of 1000 k-points Info(tddftsplr): 534 of 1000 k-points Info(tddftsplr): 35 of 1000 k-points Info(tddftsplr): 535 of 1000 k-points Info(tddftsplr): 36 of 1000 k-points Info(tddftsplr): 536 of 1000 k-points Info(tddftsplr): 37 of 1000 k-points Info(tddftsplr): 537 of 1000 k-points Info(tddftsplr): 38 of 1000 k-points Info(tddftsplr): 538 of 1000 k-points Info(tddftsplr): 39 of 1000 k-points Info(tddftsplr): 539 of 1000 k-points Info(tddftsplr): 40 of 1000 k-points Info(tddftsplr): 540 of 1000 k-points Info(tddftsplr): 41 of 1000 k-points Info(tddftsplr): 541 of 1000 k-points Info(tddftsplr): 42 of 1000 k-points Info(tddftsplr): 542 of 1000 k-points Info(tddftsplr): 43 of 1000 k-points Info(tddftsplr): 543 of 1000 k-points Info(tddftsplr): 44 of 1000 k-points Info(tddftsplr): 544 of 1000 k-points Info(tddftsplr): 45 of 1000 k-points Info(tddftsplr): 545 of 1000 k-points Info(tddftsplr): 46 of 1000 k-points Info(tddftsplr): 546 of 1000 k-points Info(tddftsplr): 47 of 1000 k-points 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Info(tddftsplr): 477 of 1000 k-points Info(tddftsplr): 978 of 1000 k-points Info(tddftsplr): 478 of 1000 k-points Info(tddftsplr): 979 of 1000 k-points Info(tddftsplr): 479 of 1000 k-points Info(tddftsplr): 980 of 1000 k-points Info(tddftsplr): 480 of 1000 k-points Info(tddftsplr): 981 of 1000 k-points Info(tddftsplr): 481 of 1000 k-points Info(tddftsplr): 982 of 1000 k-points Info(tddftsplr): 482 of 1000 k-points Info(tddftsplr): 483 of 1000 k-points Info(tddftsplr): 983 of 1000 k-points Info(tddftsplr): 484 of 1000 k-points Info(tddftsplr): 984 of 1000 k-points Info(tddftsplr): 485 of 1000 k-points Info(tddftsplr): 985 of 1000 k-points Info(tddftsplr): 986 of 1000 k-points Info(tddftsplr): 486 of 1000 k-points Info(tddftsplr): 987 of 1000 k-points Info(tddftsplr): 487 of 1000 k-points Info(tddftsplr): 988 of 1000 k-points Info(tddftsplr): 488 of 1000 k-points Info(tddftsplr): 989 of 1000 k-points Info(tddftsplr): 489 of 1000 k-points Info(tddftsplr): 990 of 1000 k-points Info(tddftsplr): 490 of 1000 k-points Info(tddftsplr): 991 of 1000 k-points Info(tddftsplr): 491 of 1000 k-points Info(tddftsplr): 492 of 1000 k-points Info(tddftsplr): 992 of 1000 k-points Info(tddftsplr): 493 of 1000 k-points Info(tddftsplr): 993 of 1000 k-points Info(tddftsplr): 994 of 1000 k-points Info(tddftsplr): 494 of 1000 k-points Info(tddftsplr): 995 of 1000 k-points Info(tddftsplr): 495 of 1000 k-points Info(tddftsplr): 996 of 1000 k-points Info(tddftsplr): 496 of 1000 k-points Info(tddftsplr): 997 of 1000 k-points Info(tddftsplr): 497 of 1000 k-points Info(tddftsplr): 998 of 1000 k-points Info(tddftsplr): 498 of 1000 k-points Info(tddftsplr): 999 of 1000 k-points Info(tddftsplr): 499 of 1000 k-points Info(tddftsplr): 1000 of 1000 k-points Info(tddftsplr): 500 of 1000 k-points Info(tddftsplr): Spin-dependent response function chi_ij(G,G',q,w) written to CHI_ij.OUT for i,j = 0-3; G = G' = 0; and all wplot frequencies q-vector (lattice coordinates) : 0.1000000000 0.3000000000 0.000000000 q-vector length : 0.4621801190 The elements of chi labeled by (i,j) form the 4x4 matrix : (_|_ _ _) chi(G,G',q,w) = ( | ) ( | ) ( | ) (0,0) is the charge-charge response drho/dv (0,1-3) is the charge-magnetisation response drho/dB (1-3,0) is the magnetisation-charge response dm/v (1-3,1-3) is the magnetisation-magnetisation response dm/dB Non-interacting Kohn-Sham reponse function written to CHI0_ij.OUT Transverse components corresponding to m_+- = m_x +- im_y written to CHI_T.OUT and CHI0_T.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1518.39249411 TEST_000.OUT : -1468.81573988 absolute difference : 49.5767542300 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.151839249411E-01 Running test in directory test_023... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff8a566873 in ??? #1 0x7fff8a567f43 in ??? #2 0x7fff8a5699eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Li) from 1.8000 to 1.7782 Info(checkmt): reduced muffin-tin radius of species 2 (F) from 2.0000 to 1.9758 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 7.552032258 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 7.388426546 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 7.438484580 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 7.722642727 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 7.441066584 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 7.607047943 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 6.579483859 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 6.449906164 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 6.350680406 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 6.432744249 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 6.257106557 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 6.223609439 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 6.136663480 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 6.164900413 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 6.296340884 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 6.214244857 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 6.295465029 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 6.090948375 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 6.261678116 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 6.086905580 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 6.179588849 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 6.033800091 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 5.953081827 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 5.873722336 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 6.335649335 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 6.103370370 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 6.187707388 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 6.230662672 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 6.262574755 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 6.287356848 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 6.012373221 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 6.198289199 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 5.967959293 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 5.993287925 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 5.907364080 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 6.156794826 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 5.898624231 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 6.192819909 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 6.178934482 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 6.240568295 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 6.365604512 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 6.243627740 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 6.131374489 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 6.303121702 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 6.123570038 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 6.264673637 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 6.191487257 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 6.225430453 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 6.212532828 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 6.342003912 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 6.232383932 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 6.462446229 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 6.418946393 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 6.355999920 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 6.353322795 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 6.336869665 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 6.084515985 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 6.093962621 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 6.140021578 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 6.320392047 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 5.867780570 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 6.226794631 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 6.117208543 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 6.211679199 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 6.271986454 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 6.057745530 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 6.255423459 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 6.075722908 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 6.103191695 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 6.223819320 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 6.190569046 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 6.105739143 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 6.127318834 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 6.125148472 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 6.225157196 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 6.294595592 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 6.235674129 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 6.009193175 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 6.142456104 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 6.233430691 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 6.170791088 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 6.111269511 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 6.235889517 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 6.250214616 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 6.337091054 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 6.332477797 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 6.286760261 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 6.110767339 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 6.191947019 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 6.171510667 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 6.325899836 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 5.988882454 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 6.289400148 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 6.093637897 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 6.226030153 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 6.065874334 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 6.075668815 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 5.977675437 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 6.115968377 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 5.969645540 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 6.051190058 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 6.166274768 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 6.106632428 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 6.183204023 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 6.072397963 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 6.061196897 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 6.074689328 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 6.066583510 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 6.091286536 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 6.307230676 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 6.254999595 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 6.079456988 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 6.312719542 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 6.088876207 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 6.120921936 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 6.132126418 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 6.113217706 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 5.973736202 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 5.926447385 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 5.959143084 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 5.987180816 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 6.162061075 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 6.005011895 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 6.086166326 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 5.989249208 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 5.962973132 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 6.135977438 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 5.914286344 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 6.097074395 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 6.134120455 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 6.157524372 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 6.142908064 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 6.224974937 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 6.175402011 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 5.980504523 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 6.021840560 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 6.055683482 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 6.238576012 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 6.159609604 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 6.059614736 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 6.010357777 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 6.152408984 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 6.010879352 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 6.255914507 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 6.070856753 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 6.118319085 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 6.069425539 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 6.086392814 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 6.099042085 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 6.085798264 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 6.224297965 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 6.248959595 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 6.181484928 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 6.249204835 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 6.145380097 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 6.349599139 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 6.263478412 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 6.430882276 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 6.301062286 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 6.402243615 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 6.407569274 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 6.280570243 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 5.862712830 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 6.233944320 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 6.222612405 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 6.170872850 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 6.025059736 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 6.075882318 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 6.069193450 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 6.135432181 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 5.981434455 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 5.904500069 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 6.120871504 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 6.103278166 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 6.105383358 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 6.040048622 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 6.124100208 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 6.181069730 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 6.184455409 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 6.134341034 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 5.958319096 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 6.149869401 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 6.174749001 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 6.192309220 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 6.114351262 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 6.036567687 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 5.960435699 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 6.032272703 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 6.215648311 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 6.317215760 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 6.083855794 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 6.171838418 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 6.102839150 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 6.242833161 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 6.178858563 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 6.204815643 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 6.233161835 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 6.044866156 Required : 12.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 6.154163506 Required : 12.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 6.153045110 Required : 12.00000000 Info(elk): current task : 120 Info(genpmat): 1 of 29 k-points Info(genpmat): 16 of 29 k-points Info(genpmat): 17 of 29 k-points Info(genpmat): 2 of 29 k-points Info(genpmat): 3 of 29 k-points Info(genpmat): 18 of 29 k-points Info(genpmat): 4 of 29 k-points Info(genpmat): 19 of 29 k-points Info(genpmat): 5 of 29 k-points Info(genpmat): 20 of 29 k-points Info(genpmat): 6 of 29 k-points Info(genpmat): 21 of 29 k-points Info(genpmat): 22 of 29 k-points Info(genpmat): 7 of 29 k-points Info(genpmat): 8 of 29 k-points Info(genpmat): 23 of 29 k-points Info(genpmat): 24 of 29 k-points Info(genpmat): 9 of 29 k-points Info(genpmat): 25 of 29 k-points Info(genpmat): 10 of 29 k-points Info(genpmat): 26 of 29 k-points Info(genpmat): 11 of 29 k-points Info(genpmat): 27 of 29 k-points Info(genpmat): 12 of 29 k-points Info(genpmat): 13 of 29 k-points Info(genpmat): 28 of 29 k-points Info(genpmat): 29 of 29 k-points Info(genpmat): 14 of 29 k-points Info(genpmat): 15 of 29 k-points Info(writepmat): momentum matrix elements written to file PMAT.OUT Info(elk): current task : 121 Info(dielectric): dielectric tensor written to EPSILON_ij.OUT optical conductivity written to SIGMA_ij.OUT for components i = 1, j = 1 Info(elk): current task : 125 Info(nonlinopt): 1 of 512 k-points Info(nonlinopt): 257 of 512 k-points Info(nonlinopt): 258 of 512 k-points Info(nonlinopt): 2 of 512 k-points Info(nonlinopt): 259 of 512 k-points Info(nonlinopt): 3 of 512 k-points Info(nonlinopt): 260 of 512 k-points Info(nonlinopt): 4 of 512 k-points Info(nonlinopt): 261 of 512 k-points Info(nonlinopt): 5 of 512 k-points Info(nonlinopt): 262 of 512 k-points Info(nonlinopt): 6 of 512 k-points Info(nonlinopt): 263 of 512 k-points Info(nonlinopt): 7 of 512 k-points Info(nonlinopt): 264 of 512 k-points Info(nonlinopt): 8 of 512 k-points Info(nonlinopt): 265 of 512 k-points Info(nonlinopt): 9 of 512 k-points Info(nonlinopt): 266 of 512 k-points Info(nonlinopt): 10 of 512 k-points Info(nonlinopt): 267 of 512 k-points Info(nonlinopt): 11 of 512 k-points Info(nonlinopt): 268 of 512 k-points Info(nonlinopt): 12 of 512 k-points Info(nonlinopt): 269 of 512 k-points Info(nonlinopt): 13 of 512 k-points Info(nonlinopt): 270 of 512 k-points Info(nonlinopt): 14 of 512 k-points Info(nonlinopt): 271 of 512 k-points Info(nonlinopt): 15 of 512 k-points Info(nonlinopt): 272 of 512 k-points Info(nonlinopt): 16 of 512 k-points Info(nonlinopt): 273 of 512 k-points Info(nonlinopt): 17 of 512 k-points Info(nonlinopt): 274 of 512 k-points Info(nonlinopt): 18 of 512 k-points Info(nonlinopt): 275 of 512 k-points Info(nonlinopt): 19 of 512 k-points Info(nonlinopt): 276 of 512 k-points Info(nonlinopt): 20 of 512 k-points Info(nonlinopt): 277 of 512 k-points Info(nonlinopt): 21 of 512 k-points Info(nonlinopt): 278 of 512 k-points Info(nonlinopt): 22 of 512 k-points Info(nonlinopt): 279 of 512 k-points Info(nonlinopt): 23 of 512 k-points Info(nonlinopt): 280 of 512 k-points Info(nonlinopt): 24 of 512 k-points Info(nonlinopt): 281 of 512 k-points Info(nonlinopt): 25 of 512 k-points Info(nonlinopt): 282 of 512 k-points Info(nonlinopt): 26 of 512 k-points Info(nonlinopt): 283 of 512 k-points Info(nonlinopt): 27 of 512 k-points Info(nonlinopt): 284 of 512 k-points Info(nonlinopt): 28 of 512 k-points Info(nonlinopt): 285 of 512 k-points Info(nonlinopt): 29 of 512 k-points Info(nonlinopt): 286 of 512 k-points Info(nonlinopt): 30 of 512 k-points Info(nonlinopt): 287 of 512 k-points Info(nonlinopt): 31 of 512 k-points Info(nonlinopt): 288 of 512 k-points Info(nonlinopt): 32 of 512 k-points Info(nonlinopt): 289 of 512 k-points Info(nonlinopt): 33 of 512 k-points Info(nonlinopt): 290 of 512 k-points Info(nonlinopt): 34 of 512 k-points Info(nonlinopt): 291 of 512 k-points Info(nonlinopt): 35 of 512 k-points Info(nonlinopt): 292 of 512 k-points Info(nonlinopt): 36 of 512 k-points Info(nonlinopt): 293 of 512 k-points Info(nonlinopt): 37 of 512 k-points Info(nonlinopt): 294 of 512 k-points Info(nonlinopt): 295 of 512 k-points Info(nonlinopt): 38 of 512 k-points Info(nonlinopt): 296 of 512 k-points Info(nonlinopt): 39 of 512 k-points Info(nonlinopt): 297 of 512 k-points Info(nonlinopt): 40 of 512 k-points Info(nonlinopt): 298 of 512 k-points Info(nonlinopt): 41 of 512 k-points Info(nonlinopt): 299 of 512 k-points Info(nonlinopt): 42 of 512 k-points Info(nonlinopt): 43 of 512 k-points Info(nonlinopt): 300 of 512 k-points Info(nonlinopt): 44 of 512 k-points Info(nonlinopt): 301 of 512 k-points Info(nonlinopt): 45 of 512 k-points Info(nonlinopt): 302 of 512 k-points Info(nonlinopt): 46 of 512 k-points Info(nonlinopt): 303 of 512 k-points Info(nonlinopt): 47 of 512 k-points Info(nonlinopt): 304 of 512 k-points Info(nonlinopt): 48 of 512 k-points Info(nonlinopt): 305 of 512 k-points Info(nonlinopt): 49 of 512 k-points Info(nonlinopt): 306 of 512 k-points Info(nonlinopt): 50 of 512 k-points Info(nonlinopt): 307 of 512 k-points Info(nonlinopt): 51 of 512 k-points Info(nonlinopt): 308 of 512 k-points Info(nonlinopt): 52 of 512 k-points Info(nonlinopt): 309 of 512 k-points Info(nonlinopt): 53 of 512 k-points Info(nonlinopt): 310 of 512 k-points Info(nonlinopt): 54 of 512 k-points Info(nonlinopt): 311 of 512 k-points Info(nonlinopt): 55 of 512 k-points Info(nonlinopt): 312 of 512 k-points Info(nonlinopt): 56 of 512 k-points Info(nonlinopt): 313 of 512 k-points Info(nonlinopt): 314 of 512 k-points 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Info(nonlinopt): 233 of 512 k-points Info(nonlinopt): 490 of 512 k-points Info(nonlinopt): 234 of 512 k-points Info(nonlinopt): 491 of 512 k-points Info(nonlinopt): 235 of 512 k-points Info(nonlinopt): 492 of 512 k-points Info(nonlinopt): 236 of 512 k-points Info(nonlinopt): 493 of 512 k-points Info(nonlinopt): 237 of 512 k-points Info(nonlinopt): 494 of 512 k-points Info(nonlinopt): 238 of 512 k-points Info(nonlinopt): 495 of 512 k-points Info(nonlinopt): 239 of 512 k-points Info(nonlinopt): 496 of 512 k-points Info(nonlinopt): 240 of 512 k-points Info(nonlinopt): 497 of 512 k-points Info(nonlinopt): 241 of 512 k-points Info(nonlinopt): 498 of 512 k-points Info(nonlinopt): 242 of 512 k-points Info(nonlinopt): 243 of 512 k-points Info(nonlinopt): 499 of 512 k-points Info(nonlinopt): 244 of 512 k-points Info(nonlinopt): 500 of 512 k-points Info(nonlinopt): 245 of 512 k-points Info(nonlinopt): 501 of 512 k-points Info(nonlinopt): 246 of 512 k-points Info(nonlinopt): 502 of 512 k-points Info(nonlinopt): 247 of 512 k-points Info(nonlinopt): 503 of 512 k-points Info(nonlinopt): 248 of 512 k-points Info(nonlinopt): 504 of 512 k-points Info(nonlinopt): 249 of 512 k-points Info(nonlinopt): 505 of 512 k-points Info(nonlinopt): 250 of 512 k-points Info(nonlinopt): 506 of 512 k-points Info(nonlinopt): 251 of 512 k-points Info(nonlinopt): 507 of 512 k-points Info(nonlinopt): 252 of 512 k-points Info(nonlinopt): 508 of 512 k-points Info(nonlinopt): 253 of 512 k-points Info(nonlinopt): 509 of 512 k-points Info(nonlinopt): 254 of 512 k-points Info(nonlinopt): 510 of 512 k-points Info(nonlinopt): 255 of 512 k-points Info(nonlinopt): 511 of 512 k-points Info(nonlinopt): 256 of 512 k-points Info(nonlinopt): 512 of 512 k-points Info(nonlinopt): susceptibility tensor written to CHI_abc.OUT interband contributions written to CHI_INTERx_abc.OUT intraband contributions written to CHI_INTRAx_abc.OUT for components a = 1, b = 1, c = 1 Info(elk): current task : 320 Info(tddftlr): 1 of 512 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of 512 k-points Info(tddftlr): 476 of 512 k-points Info(tddftlr): 214 of 512 k-points Info(tddftlr): 477 of 512 k-points Info(tddftlr): 215 of 512 k-points Info(tddftlr): 478 of 512 k-points Info(tddftlr): 216 of 512 k-points Info(tddftlr): 479 of 512 k-points Info(tddftlr): 217 of 512 k-points Info(tddftlr): 480 of 512 k-points Info(tddftlr): 218 of 512 k-points Info(tddftlr): 481 of 512 k-points Info(tddftlr): 482 of 512 k-points Info(tddftlr): 219 of 512 k-points Info(tddftlr): 483 of 512 k-points Info(tddftlr): 220 of 512 k-points Info(tddftlr): 484 of 512 k-points Info(tddftlr): 221 of 512 k-points Info(tddftlr): 222 of 512 k-points Info(tddftlr): 485 of 512 k-points Info(tddftlr): 486 of 512 k-points Info(tddftlr): 223 of 512 k-points Info(tddftlr): 224 of 512 k-points Info(tddftlr): 487 of 512 k-points Info(tddftlr): 225 of 512 k-points Info(tddftlr): 488 of 512 k-points Info(tddftlr): 226 of 512 k-points Info(tddftlr): 489 of 512 k-points Info(tddftlr): 227 of 512 k-points Info(tddftlr): 490 of 512 k-points Info(tddftlr): 228 of 512 k-points Info(tddftlr): 491 of 512 k-points Info(tddftlr): 229 of 512 k-points Info(tddftlr): 492 of 512 k-points Info(tddftlr): 493 of 512 k-points Info(tddftlr): 230 of 512 k-points Info(tddftlr): 494 of 512 k-points Info(tddftlr): 231 of 512 k-points Info(tddftlr): 495 of 512 k-points Info(tddftlr): 232 of 512 k-points Info(tddftlr): 496 of 512 k-points Info(tddftlr): 233 of 512 k-points Info(tddftlr): 497 of 512 k-points Info(tddftlr): 234 of 512 k-points Info(tddftlr): 498 of 512 k-points Info(tddftlr): 235 of 512 k-points Info(tddftlr): 499 of 512 k-points Info(tddftlr): 236 of 512 k-points Info(tddftlr): 500 of 512 k-points Info(tddftlr): 237 of 512 k-points Info(tddftlr): 501 of 512 k-points Info(tddftlr): 238 of 512 k-points Info(tddftlr): 502 of 512 k-points Info(tddftlr): 239 of 512 k-points Info(tddftlr): 503 of 512 k-points Info(tddftlr): 240 of 512 k-points Info(tddftlr): 504 of 512 k-points Info(tddftlr): 241 of 512 k-points Info(tddftlr): 505 of 512 k-points Info(tddftlr): 242 of 512 k-points Info(tddftlr): 506 of 512 k-points Info(tddftlr): 243 of 512 k-points Info(tddftlr): 507 of 512 k-points Info(tddftlr): 244 of 512 k-points Info(tddftlr): 508 of 512 k-points Info(tddftlr): 245 of 512 k-points Info(tddftlr): 509 of 512 k-points Info(tddftlr): 246 of 512 k-points Info(tddftlr): 510 of 512 k-points Info(tddftlr): 247 of 512 k-points Info(tddftlr): 511 of 512 k-points Info(tddftlr): 248 of 512 k-points Info(tddftlr): 249 of 512 k-points Info(tddftlr): 512 of 512 k-points Info(tddftlr): 250 of 512 k-points Info(tddftlr): 251 of 512 k-points Info(tddftlr): 252 of 512 k-points Info(tddftlr): 253 of 512 k-points Info(tddftlr): 254 of 512 k-points Info(tddftlr): 255 of 512 k-points Info(tddftlr): 256 of 512 k-points Info(tddftlr): done 10 bootstrap iterations head of matrix v.f_xc : 0.8402731054 0.5498753105E-15 Info(tddftlr): done 20 bootstrap iterations head of matrix v.f_xc : 0.8424492936 0.3909731992E-15 Info(tddftlr): done 30 bootstrap iterations head of matrix v.f_xc : 0.8429738194 0.3111367556E-15 Info(tddftlr): done 40 bootstrap iterations head of matrix v.f_xc : 0.8431342746 0.2719722887E-15 Info(tddftlr): done 50 bootstrap iterations head of matrix v.f_xc : 0.8431861682 0.2540915170E-15 Info(tddftlr): done 60 bootstrap iterations head of matrix v.f_xc : 0.8432032465 0.2464136502E-15 Info(tddftlr): done 70 bootstrap iterations head of matrix v.f_xc : 0.8432088991 0.2433130896E-15 Info(tddftlr): done 80 bootstrap iterations head of matrix v.f_xc : 0.8432107735 0.2420630966E-15 Info(tddftlr): done 90 bootstrap iterations head of matrix v.f_xc : 0.8432113954 0.2415544803E-15 Info(tddftlr): done 100 bootstrap iterations head of matrix v.f_xc : 0.8432116019 0.2413639295E-15 Info(tddftlr): done 110 bootstrap iterations head of matrix v.f_xc : 0.8432116704 0.2413133805E-15 Info(tddftlr): done 120 bootstrap iterations head of matrix v.f_xc : 0.8432116931 0.2412740133E-15 Info(tddftlr): Dielectric tensor written to EPSILON_TDDFT_ij.OUT Inverse written to EPSINV_TDDFT_ij.OUT Macroscopic part written to EPSM_TDDFT_ij.OUT for components i = 1, j = 1 q-vector (lattice coordinates) : 0.000000000 0.000000000 0.000000000 q-vector length : 0.000000000 Faraday angle parameters Δδ and Δβ written to FARADAY.OUT MOKE Kerr angle written to KERR_TDDFT.OUT Magnetic linear dichroism (MLD) spectrum written to MLD.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -106.905945872 TEST_000.OUT : -112.866190116 absolute difference : 5.96024424400 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.106905945872E-02 Running test in directory test_024... Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 1.6441 Info(checkmt): reduced muffin-tin radius of species 2 (O) from 1.8000 to 1.3452 Info(findsymcrys): atomic basis shift (lattice) : -0.4650000000 0.000000000 0.000000000 See GEOMETRY.OUT for new atomic positions Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 1846 The leading minor of the overlap matrix of order 903 is not positive definite Order of overlap matrix : 943 Running test in directory test_025... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff7d6a6873 in ??? #1 0x7fff7d6a7f43 in ??? #2 0x7fff7d6a99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Co) from 2.4000 to 2.3401 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 17.71768676 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 18.21525312 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -36.81253331 -4.383400000 for s.c. loop 3 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 24.93866576 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 17.64959332 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -94.63637684 -4.383400000 for s.c. loop 5 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 32.10549083 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 17.88844336 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 17.52892654 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -9.360855996 -4.383400000 for s.c. loop 8 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 22.82270413 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 17.52283335 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 17.00249440 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 17.04927508 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 16.80162212 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.558881859 -4.383400000 for s.c. loop 13 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 16.54387340 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.527749643 -4.383400000 for s.c. loop 14 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 16.76222922 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 15 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 18.40900871 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.506488089 -4.383400000 for s.c. loop 16 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 16.71037678 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 17 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 18.40297614 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 18 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 18.21585051 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 19 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 18.25385446 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.680407080 -4.383400000 for s.c. loop 20 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 16.66056691 Required : 27.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 16.66380213 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.411109989 -4.383400000 for s.c. loop 22 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 16.65878589 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.104014448 -4.383400000 for s.c. loop 23 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 16.78077480 Required : 27.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.957703362 -4.383400000 for s.c. loop 24 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 16.64066747 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 25 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 17.99597685 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 26 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 17.84399059 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 27 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 17.89039032 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 28 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 18.13597948 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 29 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 18.26411114 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 30 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 18.14852379 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 31 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 18.30571988 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 32 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 18.20993806 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 33 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 18.09412138 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 34 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 18.21395576 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 35 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 18.22771365 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 36 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 18.31623159 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 37 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 18.14199682 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 38 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 18.22321239 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 39 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 18.15856679 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 40 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 18.14389694 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 41 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 18.21733319 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 42 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 18.08235476 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 43 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 18.31489422 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 44 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 18.38005516 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 45 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.792810184 -4.383400000 for s.c. loop 45 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 18.23281807 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 46 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 18.11147683 Required : 27.00000000 Warning(linengy): could not find 1 linearisation energies in s.c. loop 47 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 18.26665307 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 48 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 18.12369332 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 49 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 18.15798327 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 50 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 17.87483665 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 51 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 17.97234755 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 52 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 17.95009806 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 53 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 17.88774732 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 54 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 18.14940759 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 55 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 18.22712332 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 56 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 18.03772099 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 57 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 18.06164058 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 58 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 18.12898343 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 59 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 18.03034283 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 60 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 17.99971053 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 61 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 18.05408149 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 62 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 17.94732260 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 63 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 19.43767297 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 64 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 19.00160017 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 65 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 18.80086996 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 66 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 18.59499966 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 67 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 18.49138941 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 68 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 18.62314164 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 69 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 17.49571984 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 70 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 18.39364611 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 71 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 18.54662823 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 72 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 18.57468384 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 73 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 18.89806298 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 74 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 18.72275609 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 75 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 18.55053355 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 76 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 18.51406753 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 77 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 18.42732557 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 78 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 18.47540856 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 79 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 18.47800954 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 80 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 18.52040123 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 81 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 18.50864345 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 82 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 18.50230348 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 83 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 18.50542849 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 84 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 18.46277249 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 85 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 18.47646741 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 86 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 18.50173735 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 87 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 18.47036208 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 88 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 18.45885106 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 89 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 18.48906039 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 90 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 18.43876055 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 91 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 18.46899006 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 92 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 18.50568493 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 93 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 18.45898895 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 94 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 18.46275064 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 95 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 18.50176130 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 96 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 18.46768502 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 97 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 18.46173807 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 98 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 18.45851803 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 18.45978282 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 100 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 18.41644846 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 101 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 18.45249434 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 102 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 18.50821263 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 103 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 18.48428463 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 104 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 18.47253876 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 105 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 18.44604337 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 106 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 18.49735168 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 107 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 18.47358262 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 108 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 18.43054871 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 109 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 18.48629413 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 110 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 18.47652766 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 111 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 18.45991025 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 18.48480444 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 113 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 18.47884015 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 114 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 18.43918093 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 115 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 18.45566874 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 116 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 18.46052600 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 117 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 18.44212855 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 118 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 18.50655759 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 119 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 18.52759522 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 120 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 18.50939984 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 121 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 18.50570857 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 122 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 18.53041062 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 123 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 18.46250402 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 124 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 18.51819537 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 125 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 18.51369303 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 126 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 18.45487437 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 127 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 18.51985365 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 128 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 18.48775983 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 129 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 18.49665473 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 130 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 18.51357897 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 131 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 18.47731008 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 18.53550963 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 18.48354768 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 134 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 18.54497234 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 135 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 18.48208341 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 136 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 18.53218596 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 137 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 18.50568046 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 138 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 18.55282420 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 139 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 18.57556679 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 18.55684150 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 141 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 18.57131530 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 142 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 18.52160650 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 143 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 18.51351855 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 144 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 18.47748054 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 145 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 18.46668149 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 146 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 18.43177499 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 147 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 18.50835055 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 148 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 18.59041630 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 149 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 18.51344820 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 150 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 18.51971870 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 151 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 18.50595220 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 152 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 18.49232131 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 153 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 18.46870258 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 154 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 18.47356812 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 155 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 18.39640319 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 156 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 18.48346075 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 157 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 18.48185784 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 158 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 18.45476080 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 159 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 18.47979102 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 160 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 18.54598702 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 161 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 18.47571310 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 162 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 18.50033380 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 163 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 18.43873721 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 164 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 18.45097336 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 165 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 18.38902427 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 166 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 18.38685158 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 167 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 18.36230355 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 168 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 18.41451427 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 169 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 18.47074751 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 170 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 18.49317886 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 171 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 18.44886273 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 172 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 18.49096572 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 173 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 18.50748999 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 174 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 18.47713756 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 175 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 18.47354113 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 176 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 18.48041360 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 177 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 18.48602250 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 178 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 18.47958632 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 179 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 18.45674213 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 180 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 18.44847952 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 18.46142912 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 182 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 18.48005254 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 183 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 18.48412224 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 184 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 18.48563427 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 185 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 18.46637862 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 186 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 18.46453334 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 187 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 18.44109665 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 188 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 18.45676401 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 189 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 18.49118581 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 190 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 18.48280583 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 191 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 18.47041624 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 192 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 18.48298994 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 193 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 18.48482403 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 194 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 18.51052513 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 195 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 18.48981222 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 196 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 18.45432608 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 197 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 18.47183029 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 198 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 18.47454797 Required : 27.00000000 Warning(linengy): could not find 2 linearisation energies in s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 18.45202273 Required : 27.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(linengy): could not find 2 linearisation energies in s.c. loop 200 Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 18.45676721 Required : 27.00000000 Info(elk): current task : 110 Warning(linengy): could not find 2 linearisation energies in s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 18.45648556 Required : 27.00000000 Info(mossbauer): Mossbauer parameters written to MOSSBAUER.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1391.14531329 TEST_000.OUT : -1357.30888701 absolute difference : 33.8364262800 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.139114531329E-01 Running test in directory test_026... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fff83db6873 in ??? #1 0x7fff83db7f43 in ??? #2 0x7fff83db99eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ni) from 2.4000 to 2.3240 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.143167700 -4.590500000 for s.c. loop 1 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 64.00952200 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 20.37818492 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 20.51206471 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 20.61186069 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 20.53469032 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 20.37939483 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 19.59005844 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 19.29575955 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.178725187 -4.590500000 for s.c. loop 9 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 18.98474923 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 19.17511967 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.171888111 -4.590500000 for s.c. loop 11 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 19.08458321 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 19.26949567 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 19.01623677 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 19.36899274 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 18.63928687 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 19.46952691 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 19.18818229 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 19.25230303 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 19.28322568 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 19.28824361 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.918170912 -4.590500000 for s.c. loop 21 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 19.31508155 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 19.28294344 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 19.19896917 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 19.24476306 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 19.17284624 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 19.20684731 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 19.22176140 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 19.30148088 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 19.27944229 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 19.23747999 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 19.28557240 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 19.26436591 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 19.29130826 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 19.27169538 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 19.37259295 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 19.26647497 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 19.34030932 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 19.29326967 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 19.33961757 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 19.36193888 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 19.35024254 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 19.28129537 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 19.30135100 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 19.43928553 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 19.37964155 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 19.37471855 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 19.30474498 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 19.31726419 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 19.31805234 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 19.30024387 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 19.31312141 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 19.26652068 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 19.40781618 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 19.25271063 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 19.27119451 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 19.34207950 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 19.23660238 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 19.31514219 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 19.34711047 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 19.40429421 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 19.34110723 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 19.42385611 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 19.33430699 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 19.40628160 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 19.24683493 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 19.44547142 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 19.31095000 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 19.29513237 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 19.31125257 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 19.36176109 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 19.36615513 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 19.31779354 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 19.36948638 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 19.39093293 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 19.43852964 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 19.62677972 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 19.37959826 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 19.35910515 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 19.27792733 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 19.38609930 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 19.35306723 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 19.28749069 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 19.38030357 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 19.26811713 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 19.34845835 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 19.20184414 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 19.30557190 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 19.22641624 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 19.28843023 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 19.34080202 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 19.49123740 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 19.64864843 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 19.31055451 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 19.35211549 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 19.19658840 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 19.40060795 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 19.32926357 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 19.41416411 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.764464253 -4.590500000 for s.c. loop 99 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 19.42756566 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 19.25829573 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 19.49735106 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 19.26511050 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 19.24815258 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 19.22610957 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 19.14990510 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 19.15856160 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 19.39024981 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 19.25768982 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 19.32150255 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 19.25741423 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 19.30730031 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.449342683 -4.590500000 for s.c. loop 112 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 19.51448561 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 19.53347352 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 19.62166746 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 19.48227931 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 19.35671130 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 19.59919617 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 19.41344093 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 19.46036231 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 19.47126725 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 19.43226520 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 19.44346183 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 19.35080155 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 19.36756851 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 19.35949233 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 19.30975667 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 19.40711062 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 19.52201412 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 19.63322506 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 19.39531434 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 19.42586261 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.748064437 -4.590500000 for s.c. loop 132 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 19.48952451 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.801433449 -4.590500000 for s.c. loop 133 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 19.38502094 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 19.40710112 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 19.35059817 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 19.64733652 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 19.29490187 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 19.36553067 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 19.68227088 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -4.974513785 -4.590500000 for s.c. loop 140 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 19.79578888 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 19.26968538 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 19.23835989 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 19.20811008 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 19.27696028 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 19.17857832 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 19.18506255 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 19.22633772 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 19.35103727 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 19.28303743 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 19.31000946 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 19.27653764 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 19.52686345 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 19.23024012 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 19.29104933 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 19.35470062 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 19.33970892 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 19.38987493 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 19.55193090 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 19.34119874 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 19.32907904 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 19.28893668 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 19.28853999 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 19.29276686 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 19.31825205 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 19.37417699 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 19.22211208 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 19.31188776 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 19.26128178 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 19.27927991 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 19.32828720 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 19.31887709 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 19.32421097 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 19.34045390 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 19.32762975 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 19.33551864 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 19.32889072 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 19.32315523 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 19.35249301 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 19.33767946 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 19.28052575 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.106169331 -4.590500000 for s.c. loop 181 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 19.55841812 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 19.14898594 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 19.25336857 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 19.14261378 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 19.16918743 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 19.31150625 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 19.29101270 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 19.28675843 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 19.58075833 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 19.18784946 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 19.32039427 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 19.12341209 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 19.33940254 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 19.26730999 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 19.32268193 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 19.16449774 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 19.14297232 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 18.92739654 Required : 28.00000000 Warning(occupy): minimum eigenvalue less than minimum linearisation energy : -5.873498045 -4.590500000 for s.c. loop 199 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 19.15990900 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 19.56597882 Required : 28.00000000 Info(elk): current task : 170 Info(writeemd): 1 of 29 k-points Info(writeemd): 16 of 29 k-points Info(writeemd): 17 of 29 k-points Info(writeemd): 18 of 29 k-points Info(writeemd): 2 of 29 k-points Info(writeemd): 19 of 29 k-points Info(writeemd): 20 of 29 k-points Info(writeemd): 3 of 29 k-points Info(writeemd): 21 of 29 k-points Info(writeemd): 4 of 29 k-points Info(writeemd): 5 of 29 k-points Info(writeemd): 6 of 29 k-points Info(writeemd): 22 of 29 k-points Info(writeemd): 7 of 29 k-points Info(writeemd): 23 of 29 k-points Info(writeemd): 24 of 29 k-points Info(writeemd): 8 of 29 k-points Info(writeemd): 25 of 29 k-points Info(writeemd): 9 of 29 k-points Info(writeemd): 10 of 29 k-points Info(writeemd): 26 of 29 k-points Info(writeemd): 11 of 29 k-points Info(writeemd): 27 of 29 k-points Info(writeemd): 12 of 29 k-points Info(writeemd): 28 of 29 k-points Info(writeemd): 29 of 29 k-points Info(writeemd): 13 of 29 k-points Info(writeemd): 14 of 29 k-points Info(writeemd): 15 of 29 k-points Info(writeemd): electron momentum density written to EMD.OUT for all H+k-vectors up to |H+k| < hkmax Info(elk): current task : 171 Info(emdplot1d): done 1 of 10 points Info(emdplot1d): done 2 of 10 points Info(emdplot1d): done 3 of 10 points Info(emdplot1d): done 4 of 10 points Info(emdplot1d): done 5 of 10 points Info(emdplot1d): done 6 of 10 points Info(emdplot1d): done 7 of 10 points Info(emdplot1d): done 8 of 10 points Info(emdplot1d): done 9 of 10 points Info(emdplot1d): done 10 of 10 points Info(emdplot): 1D electron momentum density written to EMD1D.OUT Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -1518.39244482 TEST_000.OUT : -1533.15570671 absolute difference : 14.7632618900 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.151839244482E-01 Running test in directory test_027... Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 208 Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.4000 to 2.2879 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.4000 to 2.2879 Info(bornechg): working on BEC_S01_A001_P1.OUT Info(checkmt): reduced muffin-tin radius of species 1 (Ga) from 2.2879 to 2.2864 Info(checkmt): reduced muffin-tin radius of species 2 (As) from 2.2879 to 2.2864 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 369 The leading minor of the overlap matrix of order 171 is not positive definite Order of overlap matrix : 198 Running test in directory test_028... Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(findsymcrys): atomic basis shift (lattice) : -0.7316652200 -0.7316652200 0.000000000 See GEOMETRY.OUT for new atomic positions Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 668 The leading minor of the overlap matrix of order 239 is not positive definite Order of overlap matrix : 429 Running test in directory test_029... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG ERROR STOP Error termination. Backtrace: #0 0x7fffb7e46873 in ??? #1 0x7fffb7e47f43 in ??? #2 0x7fffb7e499eb in ??? #3 0x100d6087 in testcheck_ at /builddir/build/BUILD/elk-8.3.22/src/testcheck.f90:42 #4 0x10017b13 in elk at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:235 #5 0x10011c63 in main at /builddir/build/BUILD/elk-8.3.22/src/elk.f90:8 Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Cr) from 2.4000 to 2.3521 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 32.21317517 Required : 48.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 32.39782233 Required : 48.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 32.35607155 Required : 48.00000000 Warning(gndstate): failed to reach self-consistency after 4 loops Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 32.25414727 Required : 48.00000000 Info(elk): current task : 700 Warning(occupyulr): minimum eigenvalue less than minimum linearisation energy : -372.9542064 -4.702000000 for s.c. loop 2 Warning(occupyulr): minimum eigenvalue less than minimum linearisation energy : -291.4324215 -4.702000000 for s.c. loop 3 Warning(gndstulr): failed to reach self-consistency after 4 loops Warning(occupyulr): minimum eigenvalue less than minimum linearisation energy : -274.3912562 -4.702000000 for s.c. loop 4 Info(elk): current task : 500 Error(testcheck): variable 1 outside tolerance for quantity 'total energy' TEST_000.OUT_ (correct value) : -2090.80527682 TEST_000.OUT : -2011.96308523 absolute difference : 78.8421915900 required relative tolerance : 0.100000000000E-04 required absolute tolerance : 0.209080527682E-01 Running test in directory test_030... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG Failed! See test.log and output files Elk code version 8.3.22 started Number of MPI processes : 1 Number of OpenMP threads per MPI process : 2 Total number of threads (MPI x OpenMP) : 2 Maximum OpenMP nesting level : 4 Number of OpenMP threads at first nesting level : 2 Number of MKL threads : 2 RAM disk enabled Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Ti) from 2.4000 to 2.3082 Info(checkmt): reduced muffin-tin radius of species 2 (C) from 1.8000 to 1.7311 Warning(rhonorm): total charge density incorrect for s.c. loop 1 Calculated : 21.52255528 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 2 Calculated : 21.49265362 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 3 Calculated : 20.67970825 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 4 Calculated : 23.30941382 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 5 Calculated : 21.96306004 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 6 Calculated : 21.34821843 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 7 Calculated : 21.32282934 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 8 Calculated : 21.69979014 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 9 Calculated : 21.90367012 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 10 Calculated : 21.91331516 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 11 Calculated : 21.92122920 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 12 Calculated : 21.93374271 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 13 Calculated : 21.92953273 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 14 Calculated : 21.92808983 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 15 Calculated : 21.92712956 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 16 Calculated : 21.92859096 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 17 Calculated : 21.92520438 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 18 Calculated : 21.92658218 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 19 Calculated : 21.90833304 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 20 Calculated : 21.92944731 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 21 Calculated : 21.93323493 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 22 Calculated : 21.93876010 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 23 Calculated : 21.92741194 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 24 Calculated : 21.93029774 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 25 Calculated : 21.93046795 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 26 Calculated : 21.92091614 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 27 Calculated : 21.92572734 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 28 Calculated : 21.92335633 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 29 Calculated : 21.92800347 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 30 Calculated : 21.90843500 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 31 Calculated : 21.92467116 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 32 Calculated : 21.92871676 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 33 Calculated : 21.92670815 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 34 Calculated : 21.93376261 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 35 Calculated : 21.93074508 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 36 Calculated : 21.92060203 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 37 Calculated : 21.92392756 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 38 Calculated : 21.97318109 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 39 Calculated : 21.90264118 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 40 Calculated : 21.89433828 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 41 Calculated : 21.93957006 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 42 Calculated : 21.92864554 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 43 Calculated : 21.93027017 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 44 Calculated : 21.97261857 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 45 Calculated : 21.92653983 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 46 Calculated : 21.92541650 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 47 Calculated : 21.94441352 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 48 Calculated : 21.95408561 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 49 Calculated : 21.93134978 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 50 Calculated : 21.93280729 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 51 Calculated : 21.93895561 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 52 Calculated : 21.93592148 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 53 Calculated : 21.93239274 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 54 Calculated : 21.92422913 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 55 Calculated : 21.93661441 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 56 Calculated : 21.93675708 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 57 Calculated : 21.93400796 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 58 Calculated : 21.95133514 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 59 Calculated : 21.93751677 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 60 Calculated : 21.93244001 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 61 Calculated : 21.91804231 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 62 Calculated : 21.92354585 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 63 Calculated : 21.92111319 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 64 Calculated : 21.92859780 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 65 Calculated : 21.93172492 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 66 Calculated : 21.96823930 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 67 Calculated : 21.92980284 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 68 Calculated : 21.92214588 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 69 Calculated : 21.93218248 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 70 Calculated : 21.92834404 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 71 Calculated : 21.92032316 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 72 Calculated : 21.90882049 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 73 Calculated : 21.92442761 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 74 Calculated : 21.93340202 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 75 Calculated : 21.92910856 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 76 Calculated : 21.92592121 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 77 Calculated : 21.92737381 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 78 Calculated : 21.93431815 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 79 Calculated : 21.95121373 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 80 Calculated : 21.93845361 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 81 Calculated : 21.93621991 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 82 Calculated : 21.93608033 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 83 Calculated : 21.93762072 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 84 Calculated : 21.93455344 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 85 Calculated : 21.93271713 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 86 Calculated : 21.93918862 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 87 Calculated : 21.93259486 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 88 Calculated : 21.93807859 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 89 Calculated : 21.91338513 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 90 Calculated : 21.91182476 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 91 Calculated : 21.92952157 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 92 Calculated : 21.93342464 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 93 Calculated : 21.92820731 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 94 Calculated : 21.93221538 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 95 Calculated : 21.93860328 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 96 Calculated : 21.93245100 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 97 Calculated : 21.96357307 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 98 Calculated : 21.92892122 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 99 Calculated : 21.92927391 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 100 Calculated : 21.92065748 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 101 Calculated : 21.91587308 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 102 Calculated : 21.92438957 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 103 Calculated : 21.91804032 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 104 Calculated : 21.92637251 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 105 Calculated : 21.91551463 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 106 Calculated : 21.92943296 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 107 Calculated : 21.92513225 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 108 Calculated : 21.92301650 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 109 Calculated : 21.93439292 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 110 Calculated : 21.93048431 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 111 Calculated : 21.93216379 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 112 Calculated : 21.93545379 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 113 Calculated : 21.92017727 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 114 Calculated : 21.92893159 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 115 Calculated : 21.92966357 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 116 Calculated : 21.93135579 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 117 Calculated : 21.93364348 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 118 Calculated : 21.91815036 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 119 Calculated : 21.93038761 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 120 Calculated : 21.94737178 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 121 Calculated : 21.94641619 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 122 Calculated : 21.93551865 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 123 Calculated : 21.93230935 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 124 Calculated : 21.92806738 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 125 Calculated : 21.92411470 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 126 Calculated : 21.93060607 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 127 Calculated : 21.91325544 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 128 Calculated : 21.93362378 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 129 Calculated : 21.92800543 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 130 Calculated : 21.92294263 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 131 Calculated : 21.93660623 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 132 Calculated : 21.95770479 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 133 Calculated : 21.96653688 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 134 Calculated : 21.92649000 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 135 Calculated : 21.93264887 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 136 Calculated : 21.93251475 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 137 Calculated : 21.93120127 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 138 Calculated : 21.92800322 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 139 Calculated : 21.92606509 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 140 Calculated : 21.93496583 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 141 Calculated : 21.92579381 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 142 Calculated : 21.92996380 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 143 Calculated : 21.92797156 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 144 Calculated : 21.94023986 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 145 Calculated : 21.93048509 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 146 Calculated : 21.93323647 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 147 Calculated : 21.92717405 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 148 Calculated : 21.93848941 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 149 Calculated : 21.93532862 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 150 Calculated : 21.93840045 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 151 Calculated : 21.93196049 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 152 Calculated : 21.92938915 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 153 Calculated : 21.92989791 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 154 Calculated : 21.91668185 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 155 Calculated : 21.92318657 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 156 Calculated : 21.93015106 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 157 Calculated : 21.93125939 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 158 Calculated : 21.92959545 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 159 Calculated : 21.93714739 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 160 Calculated : 21.93481042 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 161 Calculated : 21.92838327 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 162 Calculated : 21.92502095 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 163 Calculated : 21.93586914 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 164 Calculated : 21.93877476 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 165 Calculated : 21.96898472 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 166 Calculated : 21.92590556 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 167 Calculated : 21.92525889 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 168 Calculated : 21.92150623 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 169 Calculated : 21.93280467 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 170 Calculated : 21.94809845 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 171 Calculated : 21.93356929 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 172 Calculated : 21.93049079 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 173 Calculated : 21.89343860 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 174 Calculated : 21.91975727 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 175 Calculated : 21.90975536 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 176 Calculated : 21.92570968 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 177 Calculated : 21.93583878 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 178 Calculated : 21.93589138 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 179 Calculated : 21.93937079 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 180 Calculated : 21.92655447 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 181 Calculated : 21.93413281 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 182 Calculated : 21.93786057 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 183 Calculated : 21.92651754 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 184 Calculated : 21.93004021 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 185 Calculated : 21.92821715 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 186 Calculated : 21.91293981 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 187 Calculated : 21.90738167 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 188 Calculated : 21.92658046 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 189 Calculated : 21.92692010 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 190 Calculated : 21.93574809 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 191 Calculated : 21.92856532 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 192 Calculated : 21.91926385 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 193 Calculated : 21.92304965 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 194 Calculated : 21.93641792 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 195 Calculated : 21.92725005 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 196 Calculated : 21.92811907 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 197 Calculated : 21.93293743 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 198 Calculated : 21.93881703 Required : 28.00000000 Warning(rhonorm): total charge density incorrect for s.c. loop 199 Calculated : 21.93713889 Required : 28.00000000 Warning(gndstate): failed to reach self-consistency after 200 loops Warning(rhonorm): total charge density incorrect for s.c. loop 200 Calculated : 21.94282037 Required : 28.00000000 Info(elk): current task : 450 Info(genafieldt): Time-dependent A-field written to AFIELDT.OUT Laser pulse and ramp parameters written to TD_INFO.OUT 1 atomic unit of time is 24.18884327 attoseconds Total simulation time : 40.00000000 in attoseconds : 967.5537306 Info(elk): current task : 460 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 249 The leading minor of the overlap matrix of order 118 is not positive definite Order of overlap matrix : 131 Error(eveqnfvz): diagonalisation failed ZHEGVX returned INFO = 209 The leading minor of the overlap matrix of order 98 is not positive definite Order of overlap matrix : 111 real 70m18.402s user 106m42.332s sys 0m39.169s + rm -rf tests tests-libxc + . /etc/profile.d/modules.sh ++ . /etc/profile.d/00-modulepath.sh +++ '[' -z /etc/modulefiles:/usr/share/modulefiles:/usr/share/modulefiles/Linux:/usr/share/modulefiles/Core:/usr/share/lmod/lmod/modulefiles/Core ']' +++ : ++ '[' -z '' ']' ++ LMOD_ALLOW_ROOT_USE=yes ++ '[' -n '' ']' ++ '[' yes '!=' yes ']' ++ '[' -z /usr/share/modulefiles ']' ++ findExec READLINK_CMD /usr/bin/readlink readlink ++ Nm=READLINK_CMD ++ confPath=/usr/bin/readlink ++ execNm=readlink ++ eval READLINK_CMD=/usr/bin/readlink +++ READLINK_CMD=/usr/bin/readlink ++ '[' '!' -x /usr/bin/readlink ']' ++ unset Nm confPath execNm ++ findExec PS_CMD /usr/bin/ps ps ++ Nm=PS_CMD ++ confPath=/usr/bin/ps ++ execNm=ps ++ eval PS_CMD=/usr/bin/ps +++ PS_CMD=/usr/bin/ps ++ '[' '!' -x /usr/bin/ps ']' ++ unset Nm confPath execNm ++ findExec EXPR_CMD /usr/bin/expr expr ++ Nm=EXPR_CMD ++ confPath=/usr/bin/expr ++ execNm=expr ++ eval EXPR_CMD=/usr/bin/expr +++ EXPR_CMD=/usr/bin/expr ++ '[' '!' -x /usr/bin/expr ']' ++ unset Nm confPath execNm ++ findExec BASENAME_CMD /usr/bin/basename basename ++ Nm=BASENAME_CMD ++ confPath=/usr/bin/basename ++ execNm=basename ++ eval BASENAME_CMD=/usr/bin/basename +++ BASENAME_CMD=/usr/bin/basename ++ '[' '!' -x /usr/bin/basename ']' ++ unset Nm confPath execNm ++ unset -f findExec ++ '[' -f /proc/34955/exe ']' +++ /usr/bin/readlink /proc/34955/exe ++ my_shell=/usr/bin/bash +++ /usr/bin/expr /usr/bin/bash : '-*\(.*\)' ++ my_shell=/usr/bin/bash +++ /usr/bin/basename /usr/bin/bash ++ my_shell=bash ++ case ${my_shell} in ++ '[' -f /usr/share/lmod/lmod/init/bash ']' ++ . /usr/share/lmod/lmod/init/bash +++ '[' -z '' ']' +++ case "$-" in +++ __lmod_vx=x +++ '[' -n x ']' +++ set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for this output (/usr/share/lmod/lmod/init/bash) Shell debugging restarted +++ unset __lmod_vx ++ unset my_shell PS_CMD EXPR_CMD BASENAME_CMD MODULEPATH_INIT LMOD_ALLOW_ROOT_USE READLINK_CMD + module unload mpi/mpich-ppc64le + local __lmod_my_status + local __lmod_sh_dbg + '[' -z '' ']' + case "$-" in + __lmod_sh_dbg=x + '[' -n x ']' + set +x Shell debugging temporarily silenced: export LMOD_SH_DBG_ON=1 for Lmod's output Shell debugging restarted + return 0 + mv tests-libxc.orig tests-libxc + mv tests.orig tests + RPM_EC=0 ++ jobs -p + exit 0 Processing files: elk-8.3.22-1.fc37.ppc64le Provides: elk = 8.3.22-1.fc37 elk(ppc-64) = 8.3.22-1.fc37 Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1 Requires: libc.so.6()(64bit) libc.so.6(GLIBC_2.17)(64bit) libc.so.6(GLIBC_2.34)(64bit) libfftw3.so.3()(64bit) libflexiblas.so.3()(64bit) libgcc_s.so.1()(64bit) libgcc_s.so.1(GCC_3.0)(64bit) libgcc_s.so.1(GCC_3.3.1)(64bit) libgcc_s.so.1(GCC_4.0.0)(64bit) libgfortran.so.5()(64bit) libgfortran.so.5(GFORTRAN_10)(64bit) libgfortran.so.5(GFORTRAN_8)(64bit) libgomp.so.1()(64bit) libgomp.so.1(GOMP_1.0)(64bit) libgomp.so.1(GOMP_4.0)(64bit) libgomp.so.1(OMP_1.0)(64bit) libgomp.so.1(OMP_3.0)(64bit) libm.so.6()(64bit) libm.so.6(GLIBC_2.17)(64bit) libm.so.6(GLIBC_2.29)(64bit) libquadmath.so.0()(64bit) libxc.so.9()(64bit) libxcf90.so.9()(64bit) rtld(GNU_HASH) Processing files: elk-openmpi-8.3.22-1.fc37.ppc64le Provides: elk-openmpi = 8.3.22-1.fc37 elk-openmpi(ppc-64) = 8.3.22-1.fc37 Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1 Requires: /usr/bin/bash libc.so.6()(64bit) libc.so.6(GLIBC_2.17)(64bit) libc.so.6(GLIBC_2.34)(64bit) libfftw3.so.3()(64bit) libflexiblas.so.3()(64bit) libgcc_s.so.1()(64bit) libgcc_s.so.1(GCC_3.0)(64bit) libgcc_s.so.1(GCC_3.3.1)(64bit) libgcc_s.so.1(GCC_4.0.0)(64bit) libgfortran.so.5()(64bit) libgfortran.so.5(GFORTRAN_10)(64bit) libgfortran.so.5(GFORTRAN_8)(64bit) libgomp.so.1()(64bit) libgomp.so.1(GOMP_1.0)(64bit) libgomp.so.1(GOMP_4.0)(64bit) libgomp.so.1(OMP_1.0)(64bit) libgomp.so.1(OMP_3.0)(64bit) libm.so.6()(64bit) libm.so.6(GLIBC_2.17)(64bit) libm.so.6(GLIBC_2.29)(64bit) libmpi.so.80()(64bit)(openmpi-ppc64le) libmpi_mpifh.so.80()(64bit)(openmpi-ppc64le) libmpi_usempi_ignore_tkr.so.80()(64bit)(openmpi-ppc64le) libmpi_usempif08.so.80()(64bit)(openmpi-ppc64le) libquadmath.so.0()(64bit) libxc.so.9()(64bit) libxcf90.so.9()(64bit) rtld(GNU_HASH) Processing files: elk-mpich-8.3.22-1.fc37.ppc64le Provides: elk-mpich = 8.3.22-1.fc37 elk-mpich(ppc-64) = 8.3.22-1.fc37 Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1 Requires: /usr/bin/bash libc.so.6()(64bit) libc.so.6(GLIBC_2.17)(64bit) libc.so.6(GLIBC_2.34)(64bit) libfftw3.so.3()(64bit) libflexiblas.so.3()(64bit) libgcc_s.so.1()(64bit) libgcc_s.so.1(GCC_3.0)(64bit) libgcc_s.so.1(GCC_3.3.1)(64bit) libgcc_s.so.1(GCC_4.0.0)(64bit) libgfortran.so.5()(64bit) libgfortran.so.5(GFORTRAN_10)(64bit) libgfortran.so.5(GFORTRAN_8)(64bit) libgomp.so.1()(64bit) libgomp.so.1(GOMP_1.0)(64bit) libgomp.so.1(GOMP_4.0)(64bit) libgomp.so.1(OMP_1.0)(64bit) libgomp.so.1(OMP_3.0)(64bit) libm.so.6()(64bit) libm.so.6(GLIBC_2.17)(64bit) libm.so.6(GLIBC_2.29)(64bit) libmpi.so.12()(64bit)(mpich-ppc64le) libmpifort.so.12()(64bit)(mpich-ppc64le) libquadmath.so.0()(64bit) libxc.so.9()(64bit) libxcf90.so.9()(64bit) rtld(GNU_HASH) Processing files: elk-species-8.3.22-1.fc37.noarch Provides: elk-species = 8.3.22-1.fc37 Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1 Processing files: elk-common-8.3.22-1.fc37.ppc64le Executing(%doc): /bin/sh -e /var/tmp/rpm-tmp.LpmQ1c + umask 022 + cd /builddir/build/BUILD + cd elk-8.3.22 + DOCDIR=/builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/share/doc/elk-common + export LC_ALL=C + LC_ALL=C + export DOCDIR + /usr/bin/mkdir -p /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/share/doc/elk-common + cp -pr COPYING /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/share/doc/elk-common + cp -pr README /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le/usr/share/doc/elk-common + RPM_EC=0 ++ jobs -p + exit 0 Provides: elk-common = 8.3.22-1.fc37 elk-common(ppc-64) = 8.3.22-1.fc37 Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1 Requires: /usr/bin/sh libc.so.6()(64bit) libc.so.6(GLIBC_2.17)(64bit) libc.so.6(GLIBC_2.34)(64bit) libgcc_s.so.1()(64bit) libgfortran.so.5()(64bit) libgfortran.so.5(GFORTRAN_10)(64bit) libgfortran.so.5(GFORTRAN_8)(64bit) libgomp.so.1()(64bit) libm.so.6()(64bit) libm.so.6(GLIBC_2.17)(64bit) libm.so.6(GLIBC_2.29)(64bit) libquadmath.so.0()(64bit) rtld(GNU_HASH) Processing files: elk-debugsource-8.3.22-1.fc37.ppc64le Provides: elk-debugsource = 8.3.22-1.fc37 elk-debugsource(ppc-64) = 8.3.22-1.fc37 Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1 Processing files: elk-debuginfo-8.3.22-1.fc37.ppc64le Provides: debuginfo(build-id) = 6f8c1206e00848bd8ca064aabbc908f48c36246d elk-debuginfo = 8.3.22-1.fc37 elk-debuginfo(ppc-64) = 8.3.22-1.fc37 Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1 Recommends: elk-debugsource(ppc-64) = 8.3.22-1.fc37 Processing files: elk-openmpi-debuginfo-8.3.22-1.fc37.ppc64le Provides: debuginfo(build-id) = 5bc0e2799197284b17fb6332b06deec4c040dde4 elk-openmpi-debuginfo = 8.3.22-1.fc37 elk-openmpi-debuginfo(ppc-64) = 8.3.22-1.fc37 Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1 Recommends: elk-debugsource(ppc-64) = 8.3.22-1.fc37 Processing files: elk-mpich-debuginfo-8.3.22-1.fc37.ppc64le Provides: debuginfo(build-id) = f0dfbecc1f4ae40c00da7c1f9cdc5e2046eb182a elk-mpich-debuginfo = 8.3.22-1.fc37 elk-mpich-debuginfo(ppc-64) = 8.3.22-1.fc37 Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1 Recommends: elk-debugsource(ppc-64) = 8.3.22-1.fc37 Processing files: elk-common-debuginfo-8.3.22-1.fc37.ppc64le Provides: debuginfo(build-id) = 2a9438251f994397e4fe651f63e535f0d2bb9be2 debuginfo(build-id) = d6fbfc44e4c40db72b11426a3df60bf8c011b116 elk-common-debuginfo = 8.3.22-1.fc37 elk-common-debuginfo(ppc-64) = 8.3.22-1.fc37 Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1 Recommends: elk-debugsource(ppc-64) = 8.3.22-1.fc37 Checking for unpackaged file(s): /usr/lib/rpm/check-files /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le Wrote: /builddir/build/RPMS/elk-openmpi-debuginfo-8.3.22-1.fc37.ppc64le.rpm Wrote: /builddir/build/RPMS/elk-debuginfo-8.3.22-1.fc37.ppc64le.rpm Wrote: /builddir/build/RPMS/elk-mpich-debuginfo-8.3.22-1.fc37.ppc64le.rpm Wrote: /builddir/build/RPMS/elk-common-8.3.22-1.fc37.ppc64le.rpm Wrote: /builddir/build/RPMS/elk-openmpi-8.3.22-1.fc37.ppc64le.rpm Wrote: /builddir/build/RPMS/elk-mpich-8.3.22-1.fc37.ppc64le.rpm Wrote: /builddir/build/RPMS/elk-8.3.22-1.fc37.ppc64le.rpm Wrote: /builddir/build/RPMS/elk-species-8.3.22-1.fc37.noarch.rpm Wrote: /builddir/build/RPMS/elk-common-debuginfo-8.3.22-1.fc37.ppc64le.rpm Wrote: /builddir/build/RPMS/elk-debugsource-8.3.22-1.fc37.ppc64le.rpm Executing(%clean): /bin/sh -e /var/tmp/rpm-tmp.BCJbnJ + umask 022 + cd /builddir/build/BUILD + cd elk-8.3.22 + /usr/bin/rm -rf /builddir/build/BUILDROOT/elk-8.3.22-1.fc37.ppc64le + RPM_EC=0 ++ jobs -p + exit 0 Child return code was: 0